Product Name

  • Name

    PHENYLSELENENYL CHLORIDE

  • EINECS 227-196-2
  • CAS No. 5707-04-0
  • Article Data21
  • CAS DataBase
  • Density
  • Solubility
  • Melting Point 59-62 °C(lit.)
  • Formula C6H5ClSe
  • Boiling Point 236.6 °C at 760 mmHg
  • Molecular Weight 191.519
  • Flash Point 96.9 °C
  • Transport Information UN 2928
  • Appearance crystalline solid
  • Safety 20/21-28-45-60-61
  • Risk Codes 23/25-33-50/53
  • Molecular Structure Molecular Structure of 5707-04-0 (PHENYLSELENENYL CHLORIDE)
  • Hazard Symbols ToxicT; DangerousN
  • Synonyms Benzeneselenylchloride;Chlorophenylselenium;Phenylselenium chloride;Phenylseleniummonochloride;Phenylselenyl chloride;
  • PSA 0.00000
  • LogP 1.16990

Synthetic route

diphenyl diselenide
1666-13-3

diphenyl diselenide

phenylselenium trichloride
42572-42-9

phenylselenium trichloride

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

Conditions
ConditionsYield
In tetrachloromethane at 20℃; for 2h;100%
diphenyl diselenide
1666-13-3

diphenyl diselenide

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

Conditions
ConditionsYield
Stage #1: diphenyl diselenide With thionyl chloride In tetrachloromethane at 20℃; for 0.5h; Inert atmosphere;
Stage #2: In tetrachloromethane at -20℃; for 2h; Inert atmosphere;
94%
With (Dichloroiodo)benzene In hexane at 20℃; for 0.333333h; Darkness;82%
With (Dichloroiodo)benzene In hexane at 20℃; for 0.333333h;82%
chloroform
67-66-3

chloroform

diphenyl diselenide
1666-13-3

diphenyl diselenide

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

phenylselenium trichloride
42572-42-9

phenylselenium trichloride

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

Conditions
ConditionsYield
at 170℃; unter vermindertem Druck;
ethyl-dichloro-phenyl-λ4-selane

ethyl-dichloro-phenyl-λ4-selane

A

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

B

chloroethane
75-00-3

chloroethane

Conditions
ConditionsYield
at 80℃;
N-phenyldichloroselenobenzeneseleninimidoyl chloride
78489-00-6

N-phenyldichloroselenobenzeneseleninimidoyl chloride

A

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

B

phenylselenium trichloride
42572-42-9

phenylselenium trichloride

Conditions
ConditionsYield
at 20℃; for 24h; Product distribution;A 75 % Turnov.
B 70 % Turnov.
C12H10Cl2N2SSe2
1352563-37-1

C12H10Cl2N2SSe2

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

Conditions
ConditionsYield
at 70℃;
Benzeneselenol
645-96-5

Benzeneselenol

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

Conditions
ConditionsYield
With N-chloro-succinimide In nitromethane at 20℃; for 0.5h; Sealed tube;
methanol
67-56-1

methanol

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

(Z)-Cyclooctene
931-88-4, 931-87-3

(Z)-Cyclooctene

trans-1-phenylseleno-2-methoxycyclooctane
73090-30-9

trans-1-phenylseleno-2-methoxycyclooctane

Conditions
ConditionsYield
at 25℃;100%
norborn-2-ene
498-66-8

norborn-2-ene

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

endo-3-chloro-exo-2-phenylselenobicyclo<2.2.1>heptane
70303-01-4

endo-3-chloro-exo-2-phenylselenobicyclo<2.2.1>heptane

Conditions
ConditionsYield
In dichloromethane100%
In water; acetonitrile for 24h; Ambient temperature;84%
In dichloromethane at 25℃;100 % Spectr.
5-Hexen-1-ol
821-41-0

5-Hexen-1-ol

Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

(2-(phenylselanylmethyl)oxane)
75526-73-7

(2-(phenylselanylmethyl)oxane)

Conditions
ConditionsYield
With pyridine In dichloromethane at 20℃;100%
With zinc(II) chloride In dichloromethane at 20℃;100%
With silver(l) oxide In dichloromethane at 20℃;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

(Z)-Cyclooctene
931-88-4, 931-87-3

(Z)-Cyclooctene

(+/-)-rel-((1RS,2SR)-2-chlorocyclooctyl)phenylselenide

(+/-)-rel-((1RS,2SR)-2-chlorocyclooctyl)phenylselenide

Conditions
ConditionsYield
In dichloromethane at 25℃;100%
In dichloromethane at 0 - 20℃; Inert atmosphere;
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

n-Pent-4-enyl alcohol
821-09-0

n-Pent-4-enyl alcohol

2-(phenylselanylmethyl)oxolane
65539-72-2

2-(phenylselanylmethyl)oxolane

Conditions
ConditionsYield
With pyridine In dichloromethane at 20℃;100%
With silver(l) oxide In dichloromethane at 20℃;99%
at 20℃; for 0.116667h; Ionic liquid;95%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

4-cycloheptene-1-carboxylic acid
1614-73-9

4-cycloheptene-1-carboxylic acid

(1α,4α,5α)-4-(phenylseleno)-6-oxabicyclo<3.2.2>nonan-7-one
63048-50-0

(1α,4α,5α)-4-(phenylseleno)-6-oxabicyclo<3.2.2>nonan-7-one

Conditions
ConditionsYield
With base In dichloromethane at -78 - 25℃; Product distribution; Mechanism; phenylselenolactonizations of unsaturated substrates (SN2 reactions);100%
With base In dichloromethane at -78 - 25℃;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

4-methyl-4-penten-1-ol
22508-64-1

4-methyl-4-penten-1-ol

2-Methyl-2-phenylselanylmethyl-tetrahydro-furan
114524-28-6

2-Methyl-2-phenylselanylmethyl-tetrahydro-furan

Conditions
ConditionsYield
With silver(l) oxide In dichloromethane at 20℃;100%
In dichloromethane at -78℃; for 2h;93%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

2,6-dimethyl-hept-6-en-2-ol
32779-58-1

2,6-dimethyl-hept-6-en-2-ol

2,6,6-trimethyl-2-(phenylselenomethyl)tetrahydropyran
114524-35-5

2,6,6-trimethyl-2-(phenylselenomethyl)tetrahydropyran

Conditions
ConditionsYield
With pyridine In dichloromethane at 20℃;100%
With silver(l) oxide In dichloromethane at 20℃;96%
In dichloromethane at -78℃; for 2h;73%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

2-diazo-1-(4-methylphenyl)ethanone
17263-64-8

2-diazo-1-(4-methylphenyl)ethanone

α-chloro-α-phenylselenomethyl p-tolyl ketone
75608-70-7

α-chloro-α-phenylselenomethyl p-tolyl ketone

Conditions
ConditionsYield
In dichloromethane for 0.5h; Ambient temperature;100%
In dichloromethane Ambient temperature; Yield given;
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

1-diazo-3-phenyl-2-propanone
4250-02-6

1-diazo-3-phenyl-2-propanone

benzyl α-chloro-α-phenylselenomethyl ketone
75608-71-8

benzyl α-chloro-α-phenylselenomethyl ketone

Conditions
ConditionsYield
In dichloromethane for 0.5h; Ambient temperature;100%
In dichloromethane Ambient temperature;
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

(S)-1-phenyl-ethylamine
2627-86-3

(S)-1-phenyl-ethylamine

N-<(S)-1-Phenylethyl>benzeneselenamide
101685-17-0

N-<(S)-1-Phenylethyl>benzeneselenamide

Conditions
ConditionsYield
With triethylamine In tetrahydrofuran at 0℃; for 2h;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

(S)-1-(1-Naphthyl)ethylamine
10420-89-0

(S)-1-(1-Naphthyl)ethylamine

N-<(S)-1-(1-Naphthyl)-ethyl>benzeneselenamide
101685-18-1

N-<(S)-1-(1-Naphthyl)-ethyl>benzeneselenamide

Conditions
ConditionsYield
With triethylamine In tetrahydrofuran at 0℃; for 2h;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

N,N,N'-tris(trimethylsilyl)benzamidine
24261-90-3

N,N,N'-tris(trimethylsilyl)benzamidine

A

diphenyl diselenide
1666-13-3

diphenyl diselenide

Conditions
ConditionsYield
In dichloromethane at 23℃; for 3h;A 100%
B 55%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

potassium trinitromethanide
14268-23-6

potassium trinitromethanide

phenyl trinitromethyl selenide
78743-52-9

phenyl trinitromethyl selenide

Conditions
ConditionsYield
In dichloromethane at 0℃; for 1.5h;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

2-(1,1-dimethylbut-3-enyl)oxazoline
104515-33-5

2-(1,1-dimethylbut-3-enyl)oxazoline

1-(2-Chloro-ethyl)-3,3-dimethyl-5-phenylselanylmethyl-pyrrolidin-2-one
107515-52-6

1-(2-Chloro-ethyl)-3,3-dimethyl-5-phenylselanylmethyl-pyrrolidin-2-one

Conditions
ConditionsYield
In acetonitrile for 12h; Ambient temperature;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

2,3,6-trimethyl-7-octen-3-ol
118989-21-2

2,3,6-trimethyl-7-octen-3-ol

6-isopropyl-3,6-dimethyl-2-(phenylselenomethyl)tetrahydropyran
118989-25-6

6-isopropyl-3,6-dimethyl-2-(phenylselenomethyl)tetrahydropyran

Conditions
ConditionsYield
With pyridine In dichloromethane at 20℃;100%
With silver(l) oxide In dichloromethane at 20℃;97%
In dichloromethane at -78℃; for 2h;66%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

(2aR,5aR,8aR,8bR)-3-(2-Hydroxy-ethoxy)-6,6,8b-trimethyl-2a,5,5a,6,7,8,8a,8b-octahydro-naphtho[1,8-bc]furan-2-one

(2aR,5aR,8aR,8bR)-3-(2-Hydroxy-ethoxy)-6,6,8b-trimethyl-2a,5,5a,6,7,8,8a,8b-octahydro-naphtho[1,8-bc]furan-2-one

C22H28O4Se

C22H28O4Se

Conditions
ConditionsYield
With N,N-diethyl-N-isopropylamine In dichloromethane at 25℃; for 0.5h;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

1-((1S,5S,10S,13R)-10,13-Dimethyl-17-octyl-4,5,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl)-2-methyl-isourea

1-((1S,5S,10S,13R)-10,13-Dimethyl-17-octyl-4,5,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-1-yl)-2-methyl-isourea

1-((1R,2S,3S,5S,10S,13R)-3-Hydroxy-10,13-dimethyl-17-octyl-2-phenylselanyl-hexadecahydro-cyclopenta[a]phenanthren-1-yl)-2-methyl-isourea

1-((1R,2S,3S,5S,10S,13R)-3-Hydroxy-10,13-dimethyl-17-octyl-2-phenylselanyl-hexadecahydro-cyclopenta[a]phenanthren-1-yl)-2-methyl-isourea

Conditions
ConditionsYield
With silica gel In chloroform at 25℃; for 16h;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

1,4-Dichloro-2-butyne
821-10-3

1,4-Dichloro-2-butyne

(E)-2-(Phenylseleno)-1,3,4-trichlorobut-2-ene
85972-08-3

(E)-2-(Phenylseleno)-1,3,4-trichlorobut-2-ene

Conditions
ConditionsYield
In acetonitrile at 25℃; for 20h;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

ethyl (2S)-pyrrolidine-2-carboxylate
5817-26-5

ethyl (2S)-pyrrolidine-2-carboxylate

N-Benzeneselenenyl-(S)-proline ethyl ester
101685-19-2

N-Benzeneselenenyl-(S)-proline ethyl ester

Conditions
ConditionsYield
With triethylamine In tetrahydrofuran at 0℃; for 2h;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

methyl 2-oxocyclopentane-1-carboxylate
10472-24-9

methyl 2-oxocyclopentane-1-carboxylate

methyl 2-oxo-1-(phenylselanyl)cyclopentane-1-carboxylate
105405-22-9

methyl 2-oxo-1-(phenylselanyl)cyclopentane-1-carboxylate

Conditions
ConditionsYield
With pyridine In dichloromethane 1.) 0 deg C, 90 min, 2.) up to RT;100%
With pyridine In dichloromethane10.1 g
With pyridine In dichloromethane at 0℃;
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

3-methyl-2-buten-1-ol
556-82-1

3-methyl-2-buten-1-ol

3-methyl-2-(phenylselenyl)-1,3-butanediol
99018-46-9

3-methyl-2-(phenylselenyl)-1,3-butanediol

Conditions
ConditionsYield
With water In acetonitrile at 20℃; for 24h;100%
In water; acetonitrile for 2h; Ambient temperature;86%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

2-methyl-3-buten-2-ol
115-18-4

2-methyl-3-buten-2-ol

3-methyl-2-(phenylselenyl)-1,3-butanediol
99018-46-9

3-methyl-2-(phenylselenyl)-1,3-butanediol

Conditions
ConditionsYield
In water; acetonitrile for 2h; Ambient temperature;100%
With water In acetonitrile at 20℃; for 24h;86%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

Thallous Phenyl Selenide
72017-00-6

Thallous Phenyl Selenide

A

diphenyl diselenide
1666-13-3

diphenyl diselenide

B

thallous chloride

thallous chloride

Conditions
ConditionsYield
In diethyl ether for 0.00833333h; Ambient temperature;A 100%
B n/a
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

(5R)-1-Benzoyl-5-benzyl-3-[(4E,6S,8E,10E,12E)-4,6,12-trimethyl-1-oxotetradecatetra-4,8,10,12-enyl]pyrrolidin-2-one
129056-32-2

(5R)-1-Benzoyl-5-benzyl-3-[(4E,6S,8E,10E,12E)-4,6,12-trimethyl-1-oxotetradecatetra-4,8,10,12-enyl]pyrrolidin-2-one

(5R)-1-Benzoyl-5-benzyl-3-phenylseleno-3-[(4E,6S,8E,10E,12E)-4,6,12-trimethyl-1-oxotetradecatetra-4,8,10,12-enyl]pyrrolidin-2-one
259136-36-2

(5R)-1-Benzoyl-5-benzyl-3-phenylseleno-3-[(4E,6S,8E,10E,12E)-4,6,12-trimethyl-1-oxotetradecatetra-4,8,10,12-enyl]pyrrolidin-2-one

Conditions
ConditionsYield
Stage #1: (5R)-1-Benzoyl-5-benzyl-3-[(4E,6S,8E,10E,12E)-4,6,12-trimethyl-1-oxotetradecatetra-4,8,10,12-enyl]pyrrolidin-2-one With lithium hexamethyldisilazane In tetrahydrofuran; hexane at -70℃; for 1h; Metallation;
Stage #2: Phenylselenyl chloride In tetrahydrofuran; hexane at -70℃; for 2h; Phenylselenenylation;
100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

1-(2-(methylthio)phenyl)-2-phenylacetylene
312612-67-2

1-(2-(methylthio)phenyl)-2-phenylacetylene

2-phenyl-3-(phenylselanyl)benzo[b]thiophene

2-phenyl-3-(phenylselanyl)benzo[b]thiophene

Conditions
ConditionsYield
In dichloromethane at 20℃; for 0.166667h;100%
In dichloromethane at 25℃; for 0.166667h;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

trimethyl{[2-(methylsulfanyl)phenyl]ethynyl}silane
415680-02-3

trimethyl{[2-(methylsulfanyl)phenyl]ethynyl}silane

3-(phenylselenenyl)-2-trimethylsilylbenzo[b]thiophene

3-(phenylselenenyl)-2-trimethylsilylbenzo[b]thiophene

Conditions
ConditionsYield
In dichloromethane at 25℃; for 0.166667h;100%
In dichloromethane at 20℃; Inert atmosphere;100%
In dichloromethane at 0 - 20℃; for 4h; Inert atmosphere;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

6-methylhept-6-en-2-ol
32779-60-5

6-methylhept-6-en-2-ol

2,6-Dimethyl-2-phenylselanylmethyl-tetrahydro-pyran
114524-34-4

2,6-Dimethyl-2-phenylselanylmethyl-tetrahydro-pyran

Conditions
ConditionsYield
With pyridine In dichloromethane at 20℃;100%
With silver(l) oxide In dichloromethane at 20℃;100%
Phenylselenyl chloride
5707-04-0

Phenylselenyl chloride

terpineol
98-55-5

terpineol

1,3,3-trimethyl-6-(phenylseleno)-2-oxabicyclo[2.2.2]octane
92691-96-8

1,3,3-trimethyl-6-(phenylseleno)-2-oxabicyclo[2.2.2]octane

Conditions
ConditionsYield
With pyridine In dichloromethane at 20℃;100%
With triethylamine In dichloromethane Reagent/catalyst;100%
With pyridine at 20℃; for 2h; Ionic liquid;71%

Benzeneselenenylchloride Specification

The Benzeneselenenylchloride, with CAS registry number 5707-04-0, belongs to the following product categories: (1)Classes of Metal Compounds; (2)Se (Selenium) Compounds; (3)Semimetal Compounds. It has the systematic name of benzeneselenenyl chloride. This chemical is a kind of crystalline solid. And the chemical formula of this chemical is C6H5ClSe. What's more, its EINECS is 227-196-2.

Physical properties of Benzeneselenenylchloride: (1)ACD/LogP: 3.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.88; (4)ACD/LogD (pH 7.4): 3.88; (5)ACD/BCF (pH 5.5): 521.37; (6)ACD/BCF (pH 7.4): 521.37; (7)ACD/KOC (pH 5.5): 3065.73; (8)ACD/KOC (pH 7.4): 3065.73; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 0 Å2; (13)Flash Point: 96.9 °C; (14)Enthalpy of Vaporization: 45.42 kJ/mol; (15)Boiling Point: 236.6 °C at 760 mmHg; (16)Vapour Pressure: 0.0722 mmHg at 25°C.

Uses of Benzeneselenenylchloride: it can be used to produce N-(phenyldichloroseleno)morpholine. This reaction will need reagent solvent CCl4. The reaction temperature is 20 ℃. The yield is about 89%.

When you are using this chemical, please be cautious about it as the following:
The Benzeneselenenylchloride is toxic by inhalation and if swallowed. It has danger of cumulative effects. And it is very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment, so avoid release it to the environment. Refer to special instructions / safety data sheets. This material and its container must be disposed of as hazardous waste. When using, do not eat or drink and do not smoke. After contact with skin, wash immediately with plenty of soap-suds. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: Cl[Se]c1ccccc1
(2)InChI: InChI=1/C6H5ClSe/c7-8-6-4-2-1-3-5-6/h1-5H
(3)InChIKey: WJCXADMLESSGRI-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C6H5ClSe/c7-8-6-4-2-1-3-5-6/h1-5H
(5)Std. InChIKey: WJCXADMLESSGRI-UHFFFAOYSA-N

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