Product Name

  • Name

    HEXACHLOROBENZENE

  • EINECS 204-273-9
  • CAS No. 118-74-1
  • Article Data246
  • CAS DataBase
  • Density 1.767 g/cm3
  • Solubility Practically insoluble in water
  • Melting Point 227-229 °C(lit.)
  • Formula C6Cl6
  • Boiling Point 324.499 °C at 760 mmHg
  • Molecular Weight 284.784
  • Flash Point 151.101 °C
  • Transport Information UN 2729
  • Appearance white powder
  • Safety 53-60-45-61
  • Risk Codes 45-48/25-50/53
  • Molecular Structure Molecular Structure of 118-74-1 (HEXACHLOROBENZENE)
  • Hazard Symbols ToxicT,DangerousN
  • Synonyms Benzene,hexachloro- (8CI,9CI);Amatin;Anticarie;Bunt-cure;Bunt-no-more;Co-opHexa;HCB;HCB (pesticide);Julin's carbon chloride;NSC9243;No Bunt;No Bunt 40;No Bunt 80;No Bunt Liquid;Pentachlorophenylchloride;Perchlorobenzene;Sanocide;Snieciotox;Zaprawa nasienna sneciotox;
  • PSA 0.00000
  • LogP 5.60700

Synthetic route

toluene
108-88-3

toluene

A

tetrachloromethane
56-23-5

tetrachloromethane

B

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With chlorine; aluminum oxide; molybdenum(VI) oxide at 380 - 400℃; for 0.00277778h; other metal oxide catalysts;A 98.2%
B 96.3%
m-xylene
108-38-3

m-xylene

A

tetrachloromethane
56-23-5

tetrachloromethane

B

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With 2,2'-azobis(isobutyronitrile); chlorine; aluminum oxide; molybdenum(VI) oxide at 380 - 400℃; for 0.00277778h;A 95.15%
B 98.06%
1,3,5-trichlorobenzene
108-70-3

1,3,5-trichlorobenzene

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With chlorine fluorosulfate In 1,1,2-Trichloro-1,2,2-trifluoroethane at -25℃;90.2%
toluene
108-88-3

toluene

A

tetrachloromethane
56-23-5

tetrachloromethane

B

hexachlorobenzene
118-74-1

hexachlorobenzene

C

α,α,2,3,4,5,6-pentachlorotoluene
2136-78-9

α,α,2,3,4,5,6-pentachlorotoluene

Conditions
ConditionsYield
With chlorine; KSK silica gel; magnesium chloride at 295 - 320℃; for 0.005h; other methal oxide and chloride catalysts;A n/a
B n/a
C 84%
RhCl(AsPh3)3
14973-92-3

RhCl(AsPh3)3

Dichloroethyne etherate
69782-67-8

Dichloroethyne etherate

A

((C6H5)3As)3ClRhC4Cl4
136445-20-0

((C6H5)3As)3ClRhC4Cl4

B

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
In diethyl ether under N2; the Rh-complex was suspensed in Et2O; dichloroethyne*Et2O added; stirred for 23 days; filtration; residue was washed with Et2O 2 times; dried; elem. anal., IR;A 63%
B 75%
hexachlorocyclopentadiene
77-47-4

hexachlorocyclopentadiene

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With hydrogen sulfide at 550℃; Mechanism;62.5%
2,3,4,5,6-pentanitroaniline 1,2-dichloroethane
21985-87-5

2,3,4,5,6-pentanitroaniline 1,2-dichloroethane

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With hydrogenchloride at 80 - 90℃; for 4h;60%
C-plasma, graphite

C-plasma, graphite

A

hexachlorobenzene
118-74-1

hexachlorobenzene

B

octachloroacenaphthylene
7267-16-5

octachloroacenaphthylene

C

decachlorocorannulene
191352-26-8

decachlorocorannulene

Conditions
ConditionsYield
With chlorine In toluene under 105.008 Torr;A 60%
B 9%
C n/a
2,3,4,5,6-pentachloroaniline
527-20-8

2,3,4,5,6-pentachloroaniline

copper(I) cyanide
544-92-3

copper(I) cyanide

A

pentachlorobenzonitrile
20925-85-3

pentachlorobenzonitrile

B

pentachlorobenzene
608-93-5

pentachlorobenzene

C

hexachlorobenzene
118-74-1

hexachlorobenzene

D

Quintozene
82-68-8

Quintozene

Conditions
ConditionsYield
With tert.-butylnitrite In dimethyl sulfoxide at 60℃; for 1.5h; Title compound not separated from byproducts;A 48%
B 30%
C 7%
D 6%
2,3,4,5,6-pentachloroaniline
527-20-8

2,3,4,5,6-pentachloroaniline

A

pentachlorobenzonitrile
20925-85-3

pentachlorobenzonitrile

B

pentachlorobenzene
608-93-5

pentachlorobenzene

C

hexachlorobenzene
118-74-1

hexachlorobenzene

D

Quintozene
82-68-8

Quintozene

Conditions
ConditionsYield
With tert.-butylnitrite In dimethyl sulfoxide at 60℃; for 1.5h; Title compound not separated from byproducts;A 48%
B 30%
C 7%
D 6%
hexachlorotropone
21505-24-8

hexachlorotropone

2,5-dihydro-2,2-dimethoxy-5,5-dimethyl-1,3,4-oxadiazole
138723-90-7

2,5-dihydro-2,2-dimethoxy-5,5-dimethyl-1,3,4-oxadiazole

A

hexachlorobenzene
118-74-1

hexachlorobenzene

B

Pentachlorbenzoesaeure-methylester
51877-62-4

Pentachlorbenzoesaeure-methylester

C

pentachlorobenzoyl chloride
1825-23-6

pentachlorobenzoyl chloride

D

methyl 2-pentachlorophenyl-2-oxo-ethanoate
38449-81-9

methyl 2-pentachlorophenyl-2-oxo-ethanoate

Conditions
ConditionsYield
In benzene at 110℃; for 24h;A 1%
B 7 % Chromat.
C 2 % Chromat.
D 44%
perchlorodiphenylmethyl radical
3225-61-4

perchlorodiphenylmethyl radical

A

pentachlorobenzene
608-93-5

pentachlorobenzene

B

hexachlorobenzene
118-74-1

hexachlorobenzene

C

Perchlorobenzophenone
33240-70-9

Perchlorobenzophenone

D

pentachloro-α,α-dichlorotoluene
2136-95-0

pentachloro-α,α-dichlorotoluene

E

pentachlorobenzoyl chloride
1825-23-6

pentachlorobenzoyl chloride

F

Perchloro-4-benzylidenecyclohexadienone
144900-71-0

Perchloro-4-benzylidenecyclohexadienone

Conditions
ConditionsYield
With oxygen In tetrachloromethane for 2h; Mechanism; Product distribution; Quantum yield; Irradiation; also without O2; other solvent; other perchlorinated arylradical;A 9 % Chromat.
B 30%
C 17%
D 4 % Chromat.
E 6 % Chromat.
F 3%
diphenyl(tetrachloro-2-pyridyl)methane
112988-74-6

diphenyl(tetrachloro-2-pyridyl)methane

A

hexachlorobenzene
118-74-1

hexachlorobenzene

B

chloro(pentachlorophenyl)(tetrachloro-2-pyridyl)methane
112988-76-8

chloro(pentachlorophenyl)(tetrachloro-2-pyridyl)methane

C

perchloro-10-phenylpyrido<1,2-a>indole
112988-75-7

perchloro-10-phenylpyrido<1,2-a>indole

D

αH-tetradecachlorodiphenyl(2-pyridyl)methane
112988-73-5

αH-tetradecachlorodiphenyl(2-pyridyl)methane

Conditions
ConditionsYield
With disulfur dichloride; aluminium trichloride; sulfuryl dichloride for 7h; Heating;A 4%
B 17%
C 4%
D 30%
pentachlorobenzene
608-93-5

pentachlorobenzene

A

hexachlorobenzene
118-74-1

hexachlorobenzene

B

Quintozene
82-68-8

Quintozene

Conditions
ConditionsYield
With antimonypentachloride; Nitryl chloride In dichloromethane at 20℃; for 1h; Product distribution; other reagent ratio, reaction time, temperature; other reageny;A 2%
B 22%
tetrachloromethane
56-23-5

tetrachloromethane

A

1,1,2,2-tetrachloroethylene
127-18-4

1,1,2,2-tetrachloroethylene

B

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
at 700℃;
tetrachloromethane
56-23-5

tetrachloromethane

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With chlorine at 550℃;
at 400 - 700℃; Leiten durch Porzellanroehren;
With pyrographite at 400 - 700℃; Leiten durch Porzellanroehren;
2-Benzoylbenzoic acid
85-52-9

2-Benzoylbenzoic acid

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With antimonypentachloride
phthalic anhydride
85-44-9

phthalic anhydride

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With chlorine; iron(III) chloride at 170 - 265℃;
benzophenone
119-61-9

benzophenone

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With antimonypentachloride
3,5-dihydroxyphenol
108-73-6

3,5-dihydroxyphenol

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With chlorosulfonic acid; sodium chloride at 180 - 200℃;
With chlorosulfonic acid at 150 - 160℃;
1,1,2,2-tetrachloroethylene
127-18-4

1,1,2,2-tetrachloroethylene

A

hexachloroethane
67-72-1

hexachloroethane

B

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
at 300 - 350℃;
at 700℃; Leiten ueber Aktivkohle;
1,1,2,2-tetrachloroethylene
127-18-4

1,1,2,2-tetrachloroethylene

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
at 723 - 800℃; Kinetics; Pyrolysis;
Leiten durch gluehende Roehren;
xanth-9-one
90-47-1

xanth-9-one

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With antimonypentachloride
naphthalene
91-20-3

naphthalene

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With chlorine dann Chlorieren mit Chlorjod auf 300-350grad;
1,2,4,5-tetrachlorobenzene
95-94-3

1,2,4,5-tetrachlorobenzene

A

pentachlorobenzene
608-93-5

pentachlorobenzene

B

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With disulfur dichloride; aluminium trichloride; thionyl chloride; sulfuryl dichloride at 40 - 80℃;
With disulfur dichloride; tetrachloromethane; aluminium trichloride; sulfuryl dichloride at 40 - 80℃;
1,2,4,5-tetrachlorobenzene
95-94-3

1,2,4,5-tetrachlorobenzene

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With chlorosulfonic acid
With disulfur dichloride; aluminium trichloride; sulfuryl dichloride
para-dichlorobenzene
106-46-7

para-dichlorobenzene

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With chlorosulfonic acid; sodium chloride at 210 - 220℃;
2,4-dichloro-1,5-dinitrobenzene
3698-83-7

2,4-dichloro-1,5-dinitrobenzene

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
With iron at 140 - 150℃; durch Chlorieren;
diethyl ether
60-29-7

diethyl ether

dichloroethyne
7572-29-4

dichloroethyne

hexachlorobenzene
118-74-1

hexachlorobenzene

Conditions
ConditionsYield
unter Druck;
hexachlorobenzene
118-74-1

hexachlorobenzene

(1-methylbenzimidazol-2-yl)acetonitrile
2735-62-8

(1-methylbenzimidazol-2-yl)acetonitrile

10-methyl-1,2,3,4-tetrachloro-11-cyanoindolo<1,2-a>benzimidazole
133560-80-2

10-methyl-1,2,3,4-tetrachloro-11-cyanoindolo<1,2-a>benzimidazole

Conditions
ConditionsYield
With potassium carbonate In N,N-dimethyl-formamide for 3h;98%
pyridine-2-acetonitrile
2739-97-1

pyridine-2-acetonitrile

hexachlorobenzene
118-74-1

hexachlorobenzene

1,2,3,4-tetrachloro-10-cyanopyrido<1,2-a>indole
133560-79-9

1,2,3,4-tetrachloro-10-cyanopyrido<1,2-a>indole

Conditions
ConditionsYield
With potassium carbonate In N,N-dimethyl-formamide for 3h;97%
hexachlorobenzene
118-74-1

hexachlorobenzene

4′-[4-(mercapto)phenyl]-2,2′:6′,2″-terpyridine

4′-[4-(mercapto)phenyl]-2,2′:6′,2″-terpyridine

1,2,3,4,5,6-hexakis((4-([2,2';6',2''-terpyridin]-4'-yl)phenyl)thio)benzene

1,2,3,4,5,6-hexakis((4-([2,2';6',2''-terpyridin]-4'-yl)phenyl)thio)benzene

Conditions
ConditionsYield
With 1,3-dimethyl-2-imidazolidinone; caesium carbonate at 60℃; for 108h; Inert atmosphere;97%
hexachlorobenzene
118-74-1

hexachlorobenzene

sodium 4-methoxyphenylthiolate
19488-09-6

sodium 4-methoxyphenylthiolate

hexakis(4-methoxy-1-phenylthio)benzene
113087-89-1

hexakis(4-methoxy-1-phenylthio)benzene

Conditions
ConditionsYield
In various solvent(s) for 5h; Heating;96%
95%
hexachlorobenzene
118-74-1

hexachlorobenzene

sodium thiophenolate
930-69-8

sodium thiophenolate

hexakis(phenylsulfanyl)benzene
61040-42-4

hexakis(phenylsulfanyl)benzene

Conditions
ConditionsYield
In various solvent(s) at 25℃; for 72h;96%
In various solvent(s) at 128℃; for 24h;23%
hexachlorobenzene
118-74-1

hexachlorobenzene

sodium isopropanethiolate
20607-43-6

sodium isopropanethiolate

hexakis(isopropylthio)benzene
74542-72-6

hexakis(isopropylthio)benzene

Conditions
ConditionsYield
In N,N,N,N,N,N-hexamethylphosphoric triamide at 20℃; for 3.5h;95%
In N,N-dimethyl-formamide at 100℃; for 0.25h;93%
hexachlorobenzene
118-74-1

hexachlorobenzene

sodium dodecanethiolate
26960-77-0

sodium dodecanethiolate

hexakis(n-dodecylthio)benzene
99147-89-4

hexakis(n-dodecylthio)benzene

Conditions
ConditionsYield
In various solvent(s) at 128℃; for 24h;95%
In N,N,N,N,N,N-hexamethylphosphoric triamide Yield given;
hexachlorobenzene
118-74-1

hexachlorobenzene

C16H13NO

C16H13NO

C102H72N6O6

C102H72N6O6

Conditions
ConditionsYield
With dichloro bis(acetonitrile) palladium(II); copper(l) iodide; diisopropylamine; XPhos In 1,4-dioxane at 100℃; for 23h; Sonogashira Cross-Coupling; Inert atmosphere;95%
hexachlorobenzene
118-74-1

hexachlorobenzene

A

1,4-dichloro-2,3,5,6-tetrafluorobenzene
1198-62-5

1,4-dichloro-2,3,5,6-tetrafluorobenzene

B

1,3-dichloro-2,4,5,6-tetrafluorobenzene
1198-61-4

1,3-dichloro-2,4,5,6-tetrafluorobenzene

C

1,2-dichloro-3,4,5,6-tetrafluorobenzene
1198-59-0

1,2-dichloro-3,4,5,6-tetrafluorobenzene

Conditions
ConditionsYield
Title compound not separated from byproducts;A 0.5%
B 94.5%
C 5%
With potassium fluoride Title compound not separated from byproducts;A 10 % Chromat.
B 67 % Chromat.
C 20 % Chromat.
chloro-trimethyl-silane
75-77-4

chloro-trimethyl-silane

hexachlorobenzene
118-74-1

hexachlorobenzene

1,1,3,3-tetrakis(trimethylsilyl)allene
3721-17-3

1,1,3,3-tetrakis(trimethylsilyl)allene

Conditions
ConditionsYield
With lithium In tetrahydrofuran at 0℃;94%
1-thiopropane
107-03-9

1-thiopropane

hexachlorobenzene
118-74-1

hexachlorobenzene

hexakis(propylthio)benzene

hexakis(propylthio)benzene

Conditions
ConditionsYield
With sodium hydride In various solvent(s) at 130℃; for 42h;93%
hexachlorobenzene
118-74-1

hexachlorobenzene

phenylacetylene
536-74-3

phenylacetylene

Hexakis(phenylethynyl)benzene
110846-75-8

Hexakis(phenylethynyl)benzene

Conditions
ConditionsYield
With dichloro bis(acetonitrile) palladium(II); copper(l) iodide; diisopropylamine; XPhos In 1,4-dioxane at 100℃; for 20h; Sonogashira coupling; Inert atmosphere; Sealed tube;93%
(ferrocenyl)dibromoborane

(ferrocenyl)dibromoborane

hexachlorobenzene
118-74-1

hexachlorobenzene

C16H9BBrCl5Fe

C16H9BBrCl5Fe

Conditions
ConditionsYield
Stage #1: hexachlorobenzene With n-butyllithium In diethyl ether; hexane at -78 - -40℃; Inert atmosphere;
Stage #2: (ferrocenyl)dibromoborane In diethyl ether; hexane at -78 - 20℃; for 14h; Inert atmosphere;
93%
hexachlorobenzene
118-74-1

hexachlorobenzene

o-methyl-thiophenolate
34878-60-9

o-methyl-thiophenolate

hexakis(2-methyl-1-phenylthio)benzene
113087-88-0

hexakis(2-methyl-1-phenylthio)benzene

Conditions
ConditionsYield
In various solvent(s) for 5h; Heating;92%
3-methoxyphenylacetonitrile
19924-43-7

3-methoxyphenylacetonitrile

hexachlorobenzene
118-74-1

hexachlorobenzene

α-(3-Methoxyphenyl)-α-(2,3,4,5,6-pentachlorophenyl)acetonitrile

α-(3-Methoxyphenyl)-α-(2,3,4,5,6-pentachlorophenyl)acetonitrile

Conditions
ConditionsYield
With n-butyllithium In diethyl ether 1.) -70 deg C, 2 h, 2.) -70 deg C to r.t.; r.t., overnight;92%
hexachlorobenzene
118-74-1

hexachlorobenzene

4-[4-(4-Isopropoxy-phenylsulfanyl)-phenylsulfanyl]-benzenethiol
203631-76-9

4-[4-(4-Isopropoxy-phenylsulfanyl)-phenylsulfanyl]-benzenethiol

C132H114O6S18

C132H114O6S18

Conditions
ConditionsYield
With 1,3-dimethyl-2-imidazolidinone; sodium hydride 1.) 25 deg C, 30 min, 2.) 50-60 deg C, 2 d;92%
hexachlorobenzene
118-74-1

hexachlorobenzene

sodium p-thiocresolate
10486-08-5

sodium p-thiocresolate

hexakis(4-methyl-1-phenylthio)benzene
55709-41-6

hexakis(4-methyl-1-phenylthio)benzene

Conditions
ConditionsYield
With 1,3-dimethyl-2-imidazolidinone for 20h; Ambient temperature;91%
hexachlorobenzene
118-74-1

hexachlorobenzene

Sodium; 4-hydroxy-benzenethiolate
35204-48-9

Sodium; 4-hydroxy-benzenethiolate

hexakis(4-hydroxy-1-phenylthio)benzene
113087-91-5

hexakis(4-hydroxy-1-phenylthio)benzene

Conditions
ConditionsYield
In various solvent(s) for 5h; Heating;90%
hexachlorobenzene
118-74-1

hexachlorobenzene

benzene
71-43-2

benzene

Conditions
ConditionsYield
With chlorobenzene; lithium chloride; magnesium chloride In N,N-dimethyl-formamide for 1h; Product distribution; electrolysis, Al cathode, graphite anode, current density 0.04 A/sm2; electrochemical reductive dehalogenation of halogenocyclopropane and halogenoaromatic compounds;90%
With [1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene]palladium iodide; potassium tert-butylate In isopropyl alcohol for 24h; Catalytic behavior; Reagent/catalyst; Inert atmosphere; Reflux;
With (S,S)-(salen)cobalt(III)(OAc) In acetonitrile Kinetics; Reagent/catalyst;
With 3% Pd/C; sodium hydroxide In methanol at 180℃; for 1h;
hexachlorobenzene
118-74-1

hexachlorobenzene

phenylacetonitrile
140-29-4

phenylacetonitrile

α-Phenyl-α-(2,3,4,5,6-pentachlorophenyl)acetonitrile

α-Phenyl-α-(2,3,4,5,6-pentachlorophenyl)acetonitrile

Conditions
ConditionsYield
With n-butyllithium In diethyl ether 1.) -70 deg C, 2 h, 2.) -70 deg C to r.t.; r.t., overnight;90%
hexachlorobenzene
118-74-1

hexachlorobenzene

para-thiocresol
106-45-6

para-thiocresol

hexakis(4-methyl-1-phenylthio)benzene
55709-41-6

hexakis(4-methyl-1-phenylthio)benzene

Conditions
ConditionsYield
With potassium carbonate In N,N-dimethyl-formamide at 60℃; for 40h; Inert atmosphere;90%
With potassium carbonate In N,N-dimethyl-formamide at 60℃; for 40h; Inert atmosphere;90%
1-ethynyl-4-fluorobenzene
766-98-3

1-ethynyl-4-fluorobenzene

hexachlorobenzene
118-74-1

hexachlorobenzene

hexakis(4-fluorophenylethynyl)benzene
1269423-27-9

hexakis(4-fluorophenylethynyl)benzene

Conditions
ConditionsYield
With dichloro bis(acetonitrile) palladium(II); copper(l) iodide; diisopropylamine; XPhos In 1,4-dioxane at 100℃; for 20h; Sonogashira coupling; Inert atmosphere; Sealed tube;89%
4-Methoxybenzenethiol
696-63-9

4-Methoxybenzenethiol

hexachlorobenzene
118-74-1

hexachlorobenzene

hexakis(4-methoxy-1-phenylthio)benzene
113087-89-1

hexakis(4-methoxy-1-phenylthio)benzene

Conditions
ConditionsYield
Stage #1: 4-Methoxybenzenethiol; hexachlorobenzene With sodium hydride at 20 - 80℃; for 5h; Inert atmosphere; Cooling with ice;
Stage #2: With sodium hydroxide In water Inert atmosphere;
88%
With 1,3-dimethyl-2-imidazolidinone; sodium hydride for 48h; Ambient temperature;70.5%
hexachlorobenzene
118-74-1

hexachlorobenzene

thiophenol
108-98-5

thiophenol

hexakis(phenylsulfanyl)benzene
61040-42-4

hexakis(phenylsulfanyl)benzene

Conditions
ConditionsYield
With potassium carbonate In N,N-dimethyl-formamide at 60℃; for 46h; Inert atmosphere;88%
hexachlorobenzene
118-74-1

hexachlorobenzene

1-ethynyl-2-methylbenzene
766-47-2

1-ethynyl-2-methylbenzene

hexakis(o-tolylethynyl)benzene
1269423-31-5

hexakis(o-tolylethynyl)benzene

Conditions
ConditionsYield
With dichloro bis(acetonitrile) palladium(II); copper(l) iodide; diisopropylamine; XPhos In 1,4-dioxane at 100℃; for 20h; Sonogashira coupling; Inert atmosphere; Sealed tube;87%
hexachlorobenzene
118-74-1

hexachlorobenzene

sodium thiomethoxide
5188-07-8

sodium thiomethoxide

Pentakis(methylthio)thiophenol
70648-33-8

Pentakis(methylthio)thiophenol

Conditions
ConditionsYield
In N,N,N,N,N,N-hexamethylphosphoric triamide at 100℃; for 2h;85%

HEXACHLOROBENZENE Chemical Properties

Hexachlorobenzene(118-74-1), or perchlorobenzene, is a chlorocarbon with the molecular formula C6Cl6. It is a white crystalline solid that has negligible solubility in water. It is soluble in diethyl ether, benzene, ethanol and chloroform. Its vapour pressure is 1.09×10-5 mmHg (1.45 mPa) at 20 °C. Its flash point is 242 °C and it sublimes at 322 °C.
IUPAC Name: 1,2,3,4,5,6-hexachlorobenzene
Molecular formula: C6Cl6
Molar mass: 284.80 g/mol
Density: 2.04 g/cm3
Melting point: 231 °C
Boiling point: 323-326 °C
Other names: Perchlorobenzene; HCB 
The Structure of Hexachlorobenzene(118-74-1):

HEXACHLOROBENZENE Uses

Hexachlorobenzene(118-74-1) is a fungicide formerly used as a seed treatment, especially on wheat to control the fungal disease bunt. It has been banned globally under the Stockholm Convention on persistent organic pollutants.

HEXACHLOROBENZENE Toxicity Data With Reference

1.   

dnd-esc 20 µmol/L

   MUREAV    Mutation Research. 89 (1981),95.
2.   

mmo-smc 100 ppm

   RSTUDV    Rivista di Scienza e Technologia degli Alimenti e di Nutrizione Umana. Review of Science and Technology of Food and Human Nutrition. 6 (1976),161.
3.   

orl-rat TDLo:2738 mg/kg/2Y-C:CAR

   PAACA3    Proceedings of the American Association for Cancer Research. 24 (1983),59.
4.   

orl-mus TDLo:6972 mg/kg/83W-C:NEO

   IJCNAW    International Journal of Cancer. 23 (1979),47.
5.   

orl-ham TDLo:1000 mg/kg/18W-C:CAR

   NATUAS    Nature. 269 (1977),510.
6.   

unr-man LDLo:220 mg/kg

   85DCAI    Poisoning; Toxicology, Symptoms, Treatments. 2 (1970),73.
7.   

orl-rat LD50:10,000 mg/kg

   85DPAN    Wirksubstanzen der Pflanzenschutz und Schadlingsbekampfungsmittel Werner Perkow,Berlin, Germany.: Verlag Paul Parey,1971/76.
8.   

ihl-rat LC50:3600 mg/m3

   85GMAT    Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure Izmerov, N.F., et al.,Moscow, USSR.: Centre of International Projects, GKNT,1982,72.
9.   

orl-mus LD50:4 g/kg

   85GMAT    Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure Izmerov, N.F., et al.,Moscow, USSR.: Centre of International Projects,

HEXACHLOROBENZENE Consensus Reports

NTP 10th Report on Carcinogens. IARC Cancer Review: Group 2B IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 7 , 1987,p. 219.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Animal Sufficient Evidence IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 20 , 1979,p. 155.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Human Limited Evidence IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 20 , 1979,p. 155.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) . Community Right-To-Know List. Reported in EPA TSCA Inventory. EPA Genetic Toxicology Program.

HEXACHLOROBENZENE Safety Profile

Confirmed carcinogen with experimental carcinogenic, neoplastigenic, and teratogenic data. A human poison by an unspecified route. Experimental reproductive effects. Mildly toxic experimentally by inhalation. Mutation data reported. A fungicide. Combustible when exposed to heat or flame. Violent reaction with dimethylformamide. To fight fire, use CO2, dry chemical. When heated to decomposition it emits highly toxic fumes of Cl. See also CHLORINATED HYDROCARBONS, AROMATIC.
Hazard Codes: T,N,Xn,Xi,F
Risk Statements: 45-48/25-50/53-67-65-62-51/53-48/20-38-11-39/23/24/25-23/24/25-66-36/38
45:  May cause cancer 
48/25:  Toxic: danger of serious damage to health by prolonged exposure if swallowed 
50/53:  Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment 
67:  Vapors may cause drowsiness and dizziness 
65:  Harmful: May cause lung damage if swallowed 
62:  Possible risk of impaired fertility 
51/53:  Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment 
48/20:  Harmful: danger of serious damage to health by prolonged exposure through inhalation 
38:  Irritating to the skin 
11:  Highly Flammable 
39/23/24/25:  Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed 
23/24/25:  Toxic by inhalation, in contact with skin and if swallowed 
66:  Repeated exposure may cause skin dryness or cracking 
36/38:  Irritating to eyes and skin 
Safety Statements: 53-45-60-61-62-36/37-33-29-16-9-26
53:  Avoid exposure - obtain special instruction before use 
45:  In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) 
60:  This material and/or its container must be disposed of as hazardous waste 
61:  Avoid release to the environment. Refer to special instructions safety data sheet 
62:  If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label 
36/37:  Wear suitable protective clothing and gloves 
33:  Take precautionary measures against static discharges 
29:  Do not empty into drains 
16:  Keep away from sources of ignition - No smoking 
9:  Keep container in a well-ventilated place 
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
RIDADR: UN 2729 6.1/PG 3
WGK Germany: 3
RTECS: DA2975000
HazardClass: 6.1(b)
PackingGroup: III

HEXACHLOROBENZENE Standards and Recommendations

ACGIH TLV: TWA 0.002 (skin); Animal Carcinogen
DFG MAK: Not Classifiable as a Human Carcinogen; BAT: 15 μg/dL in plasma/serum
DOT Classification:  6.1; Label: KEEP AWAY FROM FOOD
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