Isobutylbenzene supplier | CasNO.538-93-2

Name
Isobutylbenzene
EINECS 208-706-2
CAS No. 538-93-2
Article Data166
CAS DataBase
Density 0.862 g/cm³
Solubility insoluble in water
Melting Point -51 °C(lit.)
Formula C₁₀H₁₄
Boiling Point 175.4 °C at 760 mmHg
Molecular Weight 134.221
Flash Point 49.9 °C
Transport Information UN 3295
Appearance Clear colourless liquid
Safety 26-36-61-60
Risk Codes 10-36/37/38-50/53
Molecular Structure
Hazard Symbols Xi,N
Synonyms Benzene,isobutyl- (8CI);(2-Methylpropyl)benzene;2-Methyl-1-phenylpropane;
PSA 0.00000
LogP 2.88510

Synthetic route

: 100-86-7
2-Methyl-1-phenyl-2-propanol

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With indium(III) chloride; diphenylsilyl chloride In 1,2-dichloro-ethane at 80℃; for 3h;	99%
With phosphorus; hydrogen iodide; iodine
With hydrogen; pyrographite at 300℃;
With platinum on activated charcoal; hydrogen at 300℃;
Multi-step reaction with 3 steps 1: 0 °C / Einleiten von HCl 2: magnesium; diethyl ether / Behandlung der erhaltenen Grignard-Verbindung mit Deutero-essigsaeure 3: platinum; ethanol / Hydrogenation View Scheme

: 65693-16-5
(2E)-2-methyl-3-phenylallyl acetate

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With sodium tetrahydroborate; nickel dichloride In methanol at 0℃; for 0.166667h;	95%

: 5674-02-2
2-methylpropylmagnesium chloride

: 108-90-7
chlorobenzene

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With iron(II) chloride tetrahydrate; 1,3-bis[2,6-diisopropylphenyl]imidazolium chloride In tetrahydrofuran at 70℃; for 3h; Inert atmosphere;	92%

: 253185-03-4, 253185-04-5
tert-butylbenzene

: 30513-14-5
{Rh-bis(1,2-bis(diphenylphosphino)ethane))}ClO4

A: 29189-87-5
hydrido{1,2-bis-(diphenylphosphino)ethane}rhodium

B: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
In benzonitrile Electrolysis; GC-MS;	A 90% B 10%

...Expand

: phenylmagnesium bromide

: 513-36-0
isobutyryl chloride

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With 1-methyl-pyrrolidin-2-one; palladium diacetate; tricyclohexylphosphine In tetrahydrofuran at 20℃; for 20h; Kumada coupling;	72%

: 151-05-3
1,1-dimethyl-2-phenylethyl acetate

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With di-tert-butyl peroxide; (4-diphenylsilylphenyl)diphenylsilane at 140℃; for 15h;	71%
With di-tert-butyl peroxide; (4-diphenylsilylphenyl)diphenylsilane at 140℃; for 15h; Product distribution; alcohol deoxygenation via acetate; reaction with Ph3SiH;	71%

: 53403-04-6
(+)-(1S,2S)-1-methyl-2-phenylcyclopropane

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With C9H24B11N2(1+)*C24BF20(1-); hydrogen In benzene at 80℃; for 24h; Autoclave;	70%

: 29817-09-2, 22664-13-7
1-methylene-2-phenylcyclopropane

A: 538-93-2
1-phenyl-2-methylpropane

B: 104-51-8
1-butylbenzene

C: 135-98-8, 36383-15-0
sec-Butylbenzene

Conditions

Conditions	Yield
With hydrogen; palladium on activated charcoal In 2,2,4-trimethylpentane Thermodynamic data; ΔHH;	A 31.47% B 64.69% C 3.84%

...Expand

: methyl (E)-2-(2-methyl-1-phenylpropylidene)hydrazine-1-carboxylate

A: 538-93-2
1-phenyl-2-methylpropane

B: 19838-99-4
1,2-bis(2-methyl-1-phenylpropylidene)hydrazine

Conditions

Conditions	Yield
With potassium hydroxide In 2,2'-[1,2-ethanediylbis(oxy)]bisethanol at 140℃; for 4h; Wolff-Kishner Reduction;	A 53% B 30%

: methyl (2-methyl-1-phenylpropan-2-yl) oxalate

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With 2-(2'-pyridyl)benzimidazole; diphenylsilane; magnesium chloride; nickel dichloride; zinc In N,N-dimethyl acetamide at 40℃; Inert atmosphere; Schlenk technique;	52%

: 760-32-7
diethylmethylsilane

: 201230-82-2
carbon monoxide

: 151-05-3
1,1-dimethyl-2-phenylethyl acetate

A: 3290-53-7
2-methyl-1-phenyl-2-propene

B: 538-93-2
1-phenyl-2-methylpropane

C: 768-49-0
(2-methyl-1-propenyl)-benzene

Conditions

Conditions	Yield
dicobalt octacarbonyl In benzene at 140℃; under 38000 Torr;	A 45% B 11% C 17%

...Expand

: 19479-63-1
1-iodo-2-methyl-2-phenylpropane

: 98-86-2
acetophenone

A: 253185-03-4, 253185-04-5
tert-butylbenzene

B: 538-93-2
1-phenyl-2-methylpropane

C: phenyl-(3-phenyl-2,2-dimethyl-1-propyl)ketone

D: phenyl(3-phenyl-3-methyl-1-butyl)ketone

Conditions

Conditions	Yield
With potassium tert-butylate In dimethyl sulfoxide for 1h; Substitution; Reduction; Rearrangement; Irradiation;	A n/a B n/a C 15.5% D 44.9%

...Expand

: 151-05-3
1,1-dimethyl-2-phenylethyl acetate

: 789-25-3
HSiPh3

A: 538-93-2
1-phenyl-2-methylpropane

B: 1929-33-5
triphenylsilyl acetate

Conditions

Conditions	Yield
With di-tert-butyl peroxide at 140℃; for 12h;	A 43% B n/a

...Expand

: 85609-09-2
1-iodo-4-isobutylbenzene

: N-propionylmorpholine sodium enolate

A: 538-93-2
1-phenyl-2-methylpropane

B: 2-(4-isobutylphenyl)-1-morpholinopropan-1-one

Conditions

Conditions	Yield
With iron(II) sulfate In ammonia for 1.5h;	A 13% B 42%

...Expand

: 4080-46-0, 23733-90-6, 30460-81-2
verbenene

A: 538-93-2
1-phenyl-2-methylpropane

B: 6069-98-3
cis-1-isopropyl-4-methyl-cyclohexane

C: 1678-98-4
isobutylcyclohexane

: 6070-02-6, 6070-03-7, 16580-23-7, 19489-02-2, 19489-03-3
cis-o-menthane

: 6070-02-6, 6070-03-7, 16580-23-7, 19489-02-2, 19489-03-3
trans-o-menthane

F: 76786-83-9
o-mentha-1(7),5,8-triene

Conditions

Conditions	Yield
In benzene at 380 - 390℃; Product distribution; hydrogenation of the reaction mixture in AcOH on 2percentPd/C, r.t.;	A 15.2% B 6.7% C 35.3% D 8.2% E 19.6% F 29%

...Expand

: 62726-47-0
β-phenylisovaleryl peroxide

A: 253185-03-4, 253185-04-5
tert-butylbenzene

B: 3290-53-7
2-methyl-1-phenyl-2-propene

C: 538-93-2
1-phenyl-2-methylpropane

D: 2173-69-5
2-methyl-2-phenyl-propan-1-ol

E: 1010-48-6
3-methyl-3-phenylbutanoic acid

F: 17648-05-4
bineophyl

Conditions

Conditions	Yield
In acetonitrile at 55℃; Product distribution; Rate constant; other solvents (benzene, cyclohexane), other temperature, ClCH2COOH as a reagent, possible ways of the products formation;	A 12.0 % Chromat. B 6.6 % Chromat. C 12.1 % Chromat. D 4.0 % Chromat. E 26.1% F 7.6 % Chromat.

...Expand

: 100-86-7
2-Methyl-1-phenyl-2-propanol

A: 3290-53-7
2-methyl-1-phenyl-2-propene

B: 538-93-2
1-phenyl-2-methylpropane

C: 768-49-0
(2-methyl-1-propenyl)-benzene

Conditions

Conditions	Yield
With triphenyl phosphite; tetraethylammonium bromide In acetonitrile constant current electrolysis, 100 mA;	A n/a B 19% C 59 % Chromat.
With triphenyl phosphite; tetraethylammonium bromide In acetonitrile constant current electrolysis, 100 mA;	A n/a B 19 % Chromat. C 19%

...Expand

: 768-49-0
(2-methyl-1-propenyl)-benzene

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
Stage #1: (2-methyl-1-propenyl)-benzene With Dimethylphenylsilane; copper(l) chloride In various solvent(s) at 20℃; for 28h; Reduction; Stage #2: With water; toluene-4-sulfonic acid In various solvent(s) at 20℃; Hydrolysis;	8%
With ethanol; platinum Hydrogenation;
With hydrogen

: 75-26-3
isopropyl bromide

: 6921-34-2
benzylmagnesium chloride

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
at 0℃; for 1h;	8%

: 75-44-5
phosgene

: 60-29-7
diethyl ether

: 515-40-2
neophyl chloride

: phenylmagnesium bromide

A: 253185-03-4, 253185-04-5
tert-butylbenzene

B: 3290-53-7
2-methyl-1-phenyl-2-propene

C: 538-93-2
1-phenyl-2-methylpropane

D: 768-49-0
(2-methyl-1-propenyl)-benzene

...Expand

: 108-86-1
bromobenzene

: 78-77-3
Isobutyl bromide

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With sodium

: 108-86-1
bromobenzene

: 513-38-2
Isobutyl iodide

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With sodium; benzene

: 2973-10-6
diisopropyl sulfate

: 1589-82-8
phenylmagnesium bromide

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With diethyl ether

: 78-77-3
Isobutyl bromide

: phenylmagnesium bromide

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
at 100℃;
With diethyl ether

: 6325-41-3
3-methyl-3-phenylbutanal

A: 253185-03-4, 253185-04-5
tert-butylbenzene

B: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With di-tert-butyl peroxide

: 80958-97-0
2,2,4,4,-Tetramethyl-1-phenyl-3-pentanon

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With sodium amide; benzene
With sodium amide; xylene

: 153339-36-7
2,2,4,4-tetramethyl-1,5-diphenyl-pentan-3-one

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With sodium amide; benzene
With sodium amide; xylene

: 926-62-5
isobutylmagnesium bromide

: phenylmagnesium bromide

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With silver(I) bromide; diethyl ether

: 920-39-8
isopropylmagnesium bromide

: 1589-82-8
phenylmagnesium bromide

: 538-93-2
1-phenyl-2-methylpropane

Conditions

Conditions	Yield
With silver(I) bromide; diethyl ether

: 538-93-2
1-phenyl-2-methylpropane

: 85609-09-2
1-iodo-4-isobutylbenzene

Conditions

Conditions	Yield
With Barluenga reagent; trifluorormethanesulfonic acid In dichloromethane for 0.5h; Ambient temperature;	100%
With silver(I) nitrite; iodine In dichloromethane at 20℃; for 96h;	70%
With silver(I) nitrite; iodine In dichloromethane at 20℃; for 96h;	70%
With iodine; iodic acid; acetic acid

: 538-93-2
1-phenyl-2-methylpropane

: 145628-18-8, 56078-31-0
ethyl 2-chloro-2-methylthio-acetate

: 75280-07-8
ethyl α-methylthio-(p-isobutylphenyl)acetate

Conditions

Conditions	Yield
tin(IV) chloride In dichloromethane for 0.666667h; Ambient temperature;	100%
tin(IV) chloride In dichloromethane for 0.666667h; Ambient temperature; Yield given;

: 538-93-2
1-phenyl-2-methylpropane

: 2528-61-2
Heptanoic acid chloride

: 148367-02-6
4'-Isobutylheptanophenone

Conditions

Conditions	Yield
Stage #1: Heptanoic acid chloride With aluminium trichloride In dichloromethane at 0℃; for 0.5h; Stage #2: 1-phenyl-2-methylpropane In dichloromethane at 0℃; for 1h; Friedel-Crafts acylation;	99.7%

: 538-93-2
1-phenyl-2-methylpropane

: 141-75-3
butyryl chloride

: 104483-01-4
1-(4-isobutyl-phenyl)-1-butanone

Conditions

Conditions	Yield
Stage #1: butyryl chloride With aluminium trichloride In dichloromethane at 0℃; for 0.5h; Stage #2: 1-phenyl-2-methylpropane In dichloromethane at 0℃; for 1h; Friedel-Crafts acylation;	99.3%

: 538-93-2
1-phenyl-2-methylpropane

: 79-03-8
propionyl chloride

: 59771-24-3
4-isobutylpropiophenone

Conditions

Conditions	Yield
Stage #1: propionyl chloride With aluminium trichloride In dichloromethane at 0℃; for 0.5h; Stage #2: 1-phenyl-2-methylpropane In dichloromethane at 0℃; for 1h; Friedel-Crafts acylation;	99.2%
With aluminum (III) chloride In neat (no solvent) at 87℃; under 10343.2 Torr; for 0.0166667h; Temperature; Pressure; Friedel-Crafts Acylation;	95%
With aluminium trichloride In carbon disulfide below 5 deg C, 1.5 h, then room temp., overnight;	88%

: 538-93-2
1-phenyl-2-methylpropane

: 638-29-9
n-valeryl chloride

: 148367-01-5
1-(4-isobutylphenyl)pentan-1-one

Conditions

Conditions	Yield
Stage #1: n-valeryl chloride With aluminium trichloride In dichloromethane at 0℃; for 0.5h; Stage #2: 1-phenyl-2-methylpropane In dichloromethane at 0℃; for 1h; Friedel-Crafts acylation;	99.1%
Stage #1: 1-phenyl-2-methylpropane; n-valeryl chloride In Petroleum ether at 20℃; for 0.25h; Stage #2: With trifluorormethanesulfonic acid In Petroleum ether for 10h; Reflux;	79.6%
With sodium hydrogencarbonate; aluminium chloride In dichloromethane

: 108-30-5
succinic acid anhydride

: 538-93-2
1-phenyl-2-methylpropane

: 73120-67-9
4-(4-isobutylphenyl)-4-oxobutanoic acid

Conditions

Conditions	Yield
Stage #1: succinic acid anhydride; 1-phenyl-2-methylpropane With aluminum (III) chloride In 1,1-dichloroethane at 20℃; for 1h; Heating / reflux; Stage #2: With hydrogenchloride In 1,1-dichloroethane; water at 20℃; for 0.166667h;	99%
With aluminium trichloride In 1,2-dichloro-ethane for 4h;	93%
With aluminium trichloride In nitrobenzene at 100℃; for 4h; Friedel Crafts succinoylation;	80%

: 538-93-2
1-phenyl-2-methylpropane

: 28975-74-8
diethyl methylthio(chloro)methanephosphonate

: 107126-09-0
[(4-Isobutyl-phenyl)-methylsulfanyl-methyl]-phosphonic acid diethyl ester

Conditions

Conditions	Yield
With tin(IV) chloride In dichloromethane for 0.666667h; Ambient temperature;	99%

: 538-93-2
1-phenyl-2-methylpropane

: 38861-78-8
1-(4-isobutyl-phenyl)-ethanone

Conditions

Conditions	Yield
With boron trifluoride; sulfur dioxide; acetic anhydride	98.7%

: 538-93-2
1-phenyl-2-methylpropane

: 75-36-5
acetyl chloride

: 38861-78-8
1-(4-isobutyl-phenyl)-ethanone

Conditions

Conditions	Yield
With aluminum (III) chloride In dichloromethane at -10℃; for 1h;	97%
With aluminium trichloride In dichloromethane at 25℃; for 12h;	95%
With aluminum (III) chloride In dichloromethane at 0℃; for 1.5h;	95%

: 538-93-2
1-phenyl-2-methylpropane

: 57181-82-5
4-bromo-isobutylbenzene

Conditions

Conditions	Yield
With hydrogen bromide; dihydrogen peroxide In 1,2-dichloro-ethane for 8h; Cooling with ice; Irradiation;	95%
With N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile) In tetrachloromethane for 1h; Bromination; Heating;	67%
With Diethyl 2-bromomalonate In benzene at 70℃; Rate constant; Irradiation; k(rel);
With Diethyl 2-bromomalonate In benzene at 70℃; Irradiation;

: 538-93-2
1-phenyl-2-methylpropane

: 4-(tert-butyl)phenyl sulfamate

: C20H27NO3S

Conditions

Conditions	Yield
With tert-butyl isocyanide; [bis(acetoxy)iodo]benzene; dirhodium(II) tetrakis[N-tetrafluorophthaloyl-(S)-tert-leucinate] at 20℃; for 16h; regioselective reaction;	95%

: 538-93-2
1-phenyl-2-methylpropane

: 609-09-6
Diethyl ketomalonate

: 83026-13-5
diethyl (4-isobutylphenyl)tartronate

Conditions

Conditions	Yield
With tin(IV) chloride In dichloromethane 1.) 0 deg C, 10 min, 2.) 20 deg C, 3 h;	94%

: 538-93-2
1-phenyl-2-methylpropane

: 111-64-8
n-octanoic acid chloride

: 93673-09-7
1-(4'-Isobutylphenyl)octan-1-one

Conditions

Conditions	Yield
With aluminium trichloride In tetrachloromethane at 0℃; for 1h;	94%
Stage #1: n-octanoic acid chloride With aluminium trichloride In dichloromethane at 0℃; for 0.5h; Stage #2: 1-phenyl-2-methylpropane In dichloromethane at 0℃; for 1h; Friedel-Crafts acylation;	77.3%

: 538-93-2
1-phenyl-2-methylpropane

: 611-70-1
phenyl isopropyl ketone

Conditions

Conditions	Yield
With tert.-butylhydroperoxide; RuIII-Montmorillonite K10 In acetonitrile for 4h; Heating;	94%
With Oxone; potassium bromide In nitromethane at 20℃; for 24h;	90%
With potassium permanganate; Tulsion T-42 exchange resin In dichloromethane; tert-butyl alcohol at 20℃; for 5h; oxidative cleavage;	88%

: 7031-27-8
(phenylthio)acetic acid chloride

: 538-93-2
1-phenyl-2-methylpropane

: 122657-57-2
4-isobutyl-α-(phenylthio)acetophenone

Conditions

Conditions	Yield
With aluminium trichloride for 1h; Ambient temperature;	91%

: 538-93-2
1-phenyl-2-methylpropane

: 75-56-9, 16033-71-9
methyloxirane

: 15687-27-1
ibuprofen

Conditions

Conditions	Yield
Stage #1: methyloxirane With aluminum (III) chloride at 20 - 30℃; for 0.5h; Green chemistry; Stage #2: 1-phenyl-2-methylpropane In water at 30 - 80℃; Green chemistry; Stage #3: With sulfuric acid; dihydrogen peroxide at 60 - 80℃; for 5h; Temperature; Reagent/catalyst; Green chemistry;	91%

: 538-93-2
1-phenyl-2-methylpropane

: 2700-22-3
Benzylidenemalononitrile

: 2-(3-methyl-1,2-diphenylbutyl)malononitrile

Conditions

Conditions	Yield
With 9-(2-mesityl)-10-methylacridinium perchlorate; 1,2-dibromomethane at 50℃; for 24h; Irradiation;	91%

: 538-93-2
1-phenyl-2-methylpropane

: 142-61-0
Hexanoyl chloride

: 146922-67-0
4'-isobutylhexanophenone

Conditions

Conditions	Yield
Stage #1: Hexanoyl chloride With aluminium trichloride In dichloromethane at 0℃; for 0.5h; Stage #2: 1-phenyl-2-methylpropane In dichloromethane at 0℃; for 1h; Friedel-Crafts acylation;	90.5%
aluminium trichloride In dichloromethane

10%-hydrochloric acid: 10%-hydrochloric acid

: 538-93-2
1-phenyl-2-methylpropane

: 59771-24-3
4-isobutylpropiophenone

Conditions

Conditions	Yield
aluminium chloride In dichloromethane; propionyl chloride	90.2%

: 538-93-2
1-phenyl-2-methylpropane

: 3282-30-2
pivaloyl chloride

: 139155-61-6
2,2-dimethyl-4'-isobutylpropiophenone

Conditions

Conditions	Yield
zinc In toluene at 70℃; for 6h; Acylation;	90%

: 35928-65-5
(methylthio)acetyl chloride

: 538-93-2
1-phenyl-2-methylpropane

: 122657-55-0
4-isobutyl-α-(methylthio)acetophenone

Conditions

Conditions	Yield
With aluminium trichloride In dichloromethane for 1h; Ambient temperature;	89%

: 538-93-2
1-phenyl-2-methylpropane

: 79-04-9
chloroacetyl chloride

: 38588-43-1
p-isobutylphenylacetic acid chloride

Conditions

Conditions	Yield
With aluminium trichloride In 1,2-dichloro-ethane at 0 - 5℃; for 4h;	89%

: 538-93-2
1-phenyl-2-methylpropane

: 552333-50-3
1-isobutyl-2,4-dinitro-benzene

Conditions

Conditions	Yield
With sulfuric acid; nitric acid at 0 - 20℃; for 0.5h;	89%

: 538-93-2
1-phenyl-2-methylpropane

: 108-24-7
acetic anhydride

: 38861-78-8
1-(4-isobutyl-phenyl)-ethanone

Conditions

Conditions	Yield
With aluminium trichloride In dichloromethane at 0℃; for 1h;	88%
With aluminium trichloride In dichloromethane at -5 - 28℃; Acylation;	70%
With trifluoroacetic acid at 100℃; for 56h; Friedel-Crafts Acylation; Inert atmosphere;	65%

: 538-93-2
1-phenyl-2-methylpropane

: 79-04-9
chloroacetyl chloride

: 56374-25-5
4-(isobutyl)phenacyl chloride

Conditions

Conditions	Yield
With aluminium trichloride In 1,2-dichloro-ethane at 0 - 5℃; for 3.5h;	87%
With aluminum (III) chloride; bismuth(III) chloride In dichloromethane at 0 - 5℃; Friedel Crafts acylation;	87%

Isobutylbenzene Chemical Properties

Molecule structure of Isobutylbenzene (CAS NO.538-93-2):

IUPAC Name: 2-Methylpropylbenzene
Molecular Weight: 134.21816 g/mol
Molecular Formula: C₁₀H₁₄
Melting Point: -51 °C(lit.)
Boiling Point: 175.4 °C at 760 mmHg
Density: 0.853 g/mL at 25 °C(lit.)
Flash Point: 49.9 °C
Storage Temp.: flammables area
Water Solubility: insoluble
Index of Refraction: 1.49
Molar Refractivity: 45.02 cm³
Molar Volume: 155.6 cm³
Surface Tension: 28.8 dyne/cm
XLogP3: 3.9
Rotatable Bond Count: 2
Exact Mass: 134.10955
MonoIsotopic Mass: 134.10955
Canonical SMILES: CC(C)CC1=CC=CC=C1
InChI: InChI=1S/C10H14/c1-9(2)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey: KXUHSQYYJYAXGZ-UHFFFAOYSA-N
EINECS: 208-706-2

Isobutylbenzene Uses

Isobutylbenzene (CAS NO.538-93-2) is used in the produced the drug of ibuprofen that can be used in analgesia, antipyretic antiphlogistic.It is also used in organic synthesis.

Isobutylbenzene Toxicity Data With Reference

orl-rat LDLo:5000 mg/kg

28ZRAQ Toxicology and Biochemistry of Aromatic Hydrocarbons Gerarde, H.,New York, NY.: Elsevier,1960,56.

Isobutylbenzene Consensus Reports

Reported in EPA TSCA Inventory.

Isobutylbenzene Safety Profile

Hazard Codes: Irritant Xi, Dangerous N
Risk Statements: 10-36/37/38-50/53
R10:Flammable.
R36/37/38:Irritating to eyes, respiratory system and skin.
R50/53:Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements: 26-36-61-60
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
S61:Avoid release to the environment. Refer to special instructions / safety data sheets.
S60:This material and its container must be disposed of as hazardous waste.
RIDADR: UN 3295 3/PG 3
WGK Germany: 3
RTECS: DA3550000
HazardClass: 3
PackingGroup: III
Mildly toxic by ingestion. An irritant and possibly narcotic. Flammable liquid when exposed to heat, sparks, or flame. Can react with oxidizing materials. Moderate explosion hazard when exposed to heat or flame. To fight fire, use foam, CO₂, dry chemical. When heated to decomposition it emits acrid smoke and fumes.

Isobutylbenzene Specification

Isobutylbenzene (CAS NO.538-93-2) is also named as (2-Methylpropyl)benzene ; 1-Phenyl-2-methylpropane ; 2-Methyl-1-phenylpropane ; 2-Phenyl-2-methylpropane ; 4-05-00-01042 (Beilstein Handbook Reference) ; BRN 1852218 ; NSC 24848 ; Benzene, (2-methylpropyl)- ; Benzene, isobutyl- . Isobutylbenzene (CAS NO.538-93-2) is colorless liquid. It is insoluble in water, soluble in alcohol, ether, benzene and acetone. It is toxic. It is flammable. So the storage environment should be ventilate, low-temperature and dry. Keep Isobutylbenzene separate from oxidant.

Product Name

Isobutylbenzene

Synthetic route

Isobutylbenzene Chemical Properties

Isobutylbenzene Uses

Isobutylbenzene Toxicity Data With Reference

Isobutylbenzene Consensus Reports

Isobutylbenzene Safety Profile

Isobutylbenzene Specification

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