α-Cumyl alcohol

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Names

[ CAS No. ]:
617-94-7

[ Name ]:
α-Cumyl alcohol

[Synonym ]:
Phenyldimethylcarbinol
Dimethylphenylmethanol
Dimethylphenylcarbinol
propan-2-ol, 2-phenyl-
α,α-Dimethylbenzyl alcohol
2-Propanol, 2-phenyl-
α-Cumyl alcohol
α,α-Dimethylbenzene methanol
2-phenylpropan-2-ol
2-Phenyl-2-propanol
Cumyl alcohol
EINECS 210-539-5
MFCD00004456
Benzenemethanol, α,α-dimethyl-
benzyl alcohol, α,α-dimethyl-
Esomeprazole Impurity 27

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
202.0±0.0 °C at 760 mmHg

[ Melting Point ]:
28-32 °C(lit.)

[ Molecular Formula ]:
C9H12O

[ Molecular Weight ]:
136.19

[ Flash Point ]:
87.8±0.0 °C

[ Exact Mass ]:
136.088821

[ PSA ]:
20.23000

[ LogP ]:
1.73

[ Vapour Pressure ]:
0.2±0.4 mmHg at 25°C

[ Index of Refraction ]:
1.518

[ Storage condition ]:
Store at 0-5°C

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DO4562000
CHEMICAL NAME :
Benzyl alcohol, alpha,alpha-dimethyl-
CAS REGISTRY NUMBER :
617-94-7
BEILSTEIN REFERENCE NO. :
1905012
LAST UPDATED :
199710
DATA ITEMS CITED :
9
MOLECULAR FORMULA :
C9-H12-O
MOLECULAR WEIGHT :
136.21

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,675,1982 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,675,1982
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ESKGA2 Eisei Kagaku. Hygienic Chemistry. (Nippon Yakugakkai, 2-12-15 Shibuya, Shibuya-ku, Tokyo 150, Japan) V.1- 1953- Volume(issue)/page/year: 24,115,1978
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
4300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 20,675,1982 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 10 mg/m3;Skin JAN 1993 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - M4400 No. of Facilities: 8 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 16 (estimated)

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Faceshields;Gloves

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R22

[ Safety Phrases ]:
S26-S36

[ RIDADR ]:
1325

[ WGK Germany ]:
3

[ RTECS ]:
DO4562000

[ HS Code ]:
2906299090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • phenylmagnesium bromide
  • Acetone
  • Cumyl hydroperoxide
  • METHYLMAGNESIUM IODIDE
  • Acetophenone
  • Cumene
  • 2-Methyl-2-phenyloxirane
  • 2-methyl-1,2-diphenyl-1-propanone
  • Bromobenzene
  • 2-methyl-2-phenyl-propanal

DownStream

  • 2-Phenyl-2-propanamine
  • 1,3,3-Trimethyl-1-phenylindan
  • 2,4-Diphenyl-4-methyl-1-pentene
  • 4-cumylphenol
  • 2-[2-(1-methyl-1-phenyl-ethyl)-phenyl]-propan-2-ol
  • 2-Phenyl-2-(trimethylsilyloxy)propane
  • Cumene
  • 2-(2-phenylpropan-2-yl)phenol
  • Hydrazinecarboxylic acid, 1-methyl-1-phenylethyl ester (9CI)
  • 2,3-Dimethyl-2,3-diphenylbutane

Customs

[ HS Code ]: 2906299090

[ Summary ]:
2906299090 other aromatic alcohols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0%

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Related Compounds

  • α-cumyl hyponitrite
  • p-(diethylthiophosphono)cumyl alcohol
  • Dicumyl peroxide
  • bi(3,4-dimethyl-α-cumyl)
  • (+)-TCC-chloroformate
  • 2-hydroxy-2'-nitro-4'-trifluoromethyl-3-α-cumyl-5-tert-octylazobenzene
  • 4-((6-Chloro-2,3-dihydro-2-methyl-3-oxobenzo[b][1,4]oxazin-4-yl)methyl)benzonitrile
  • N1-(benzo[d][1,3]dioxol-5-yl)-N2-(2-hydroxy-2-phenyl-2-(tetrahydro-2H-pyran-4-yl)ethyl)oxalamide
  • N1-(2-hydroxy-2-(4-(thiophen-3-yl)phenyl)ethyl)-N2-(3-(2-oxopyrrolidin-1-yl)phenyl)oxalamide
  • N-(3-(benzofuran-2-yl)propyl)-2-(m-tolyl)acetamide
  • Pyridin-2-yl(3-(pyrimidin-2-ylamino)azetidin-1-yl)methanone
  • 4-((4-(1H-pyrazol-1-yl)phenyl)sulfonyl)-7-(thiophen-2-yl)-1,4-thiazepane 1,1-dioxide
  • 1-(4,4-Difluorocyclohexyl)-3-(4-methoxyphenethyl)urea
  • 5-bromo-2-chloro-N-(4-(thiophen-2-yl)tetrahydro-2H-pyran-4-yl)benzamide
  • (4-(Benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)(6-((tetrahydrofuran-2-yl)methoxy)pyridin-3-yl)methanone
  • N-((3-(4-fluorophenyl)-2-oxooxazolidin-5-yl)methyl)-2-(2-methoxyethoxy)isonicotinamide