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ChemicalBook--->CAS DataBase List--->617-94-7

617-94-7

617-94-7 Structure

617-94-7 Structure
IdentificationMore
[Name]

2-PHENYL-2-PROPANOL
[CAS]

617-94-7
[Synonyms]

2-PHENYL-2-PROPANOL
A,A-DIMETHYLBENZYL ALCOHOL
ALPHA,ALPHA-DIMETHYLBENZYL ALCOHOL
ALPHA-CUMYL ALCOHOL
DIMETHYLPHENYLCARBINOL
.alpha.,.alpha.-dimethyl-Benzenemethanol
1-Hydroxycumene
1-Methyl-1-phenylethanol
2-phenyl-2-propano
2-Phenylisopropanol
2-phenyl-propan-2-ol
2-Propanol, 2-phenyl-
alpha,alpha-dimethyl-benzenemethano
alpha,alpha-Dimethylbenzenemethanol
alpha,alpha-dimethyl-benzylalcoho
Benzyl alcohol, alpha,alpha-dimethyl-
Dimethylphenylmethanol
Phenyldimethylcarbinol
α,α-Dimethylbenzylalcohol
2-Phenyl-2-propanol, 98+%
[EINECS(EC#)]

210-539-5
[Molecular Formula]

C9H12O
[MDL Number]

MFCD00004456
[Molecular Weight]

136.19
[MOL File]

617-94-7.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to yellow liquid after melting
[Melting point ]

28-32 °C (lit.)
[Boiling point ]

202 °C (lit.)
[density ]

0.973 g/mL at 25 °C(lit.)
[vapor pressure ]

23Pa at 20℃
[refractive index ]

n20/D 1.5196(lit.)
[Fp ]

190 °F
[storage temp. ]

Store at 0-5°C
[solubility ]

Chloroform, Methanol (Slightly)
[form ]

Liquid After Melting
[pka]

14.49±0.29(Predicted)
[color ]

Clear colorless to light yellow
[Odor]

at 100.00 %. mild green sweet earthy
[Odor Type]

green
[Water Solubility ]

Insoluble in water.
[Detection Methods]

GC
[BRN ]

1905012
[LogP]

1.89 at 25℃
[CAS DataBase Reference]

617-94-7(CAS DataBase Reference)
[EPA Substance Registry System]

2-Phenyl-2-propanol (617-94-7)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

1325
[WGK Germany ]

3
[RTECS ]

DO4562000
[Hazard Note ]

Irritant
[TSCA ]

Yes
[HS Code ]

29062990
[Hazardous Substances Data]

617-94-7(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Diethyl ether-->Iodomethane-->Ethyl benzoate-->2-PHENYLPROPYLENE OXIDE-->Methyl benzoate-->Cumyl hydroperoxide-->2-Phenyl-1-propene
[Preparation Products]

IODOCYCLOHEXANE-->1H-Azepine-1-carbothioic acid, hexahydro-, S-(1-methyl-1-phenylethyl) ester-->ALPHA,ALPHA-DIMETHYLBENZYL CHLORIDE-->3,3-diMethylbenzo[c][1,2]oxaborol-1(3H)-ol-->3,3-dimethylphthalide
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to yellow liquid after melting
[Uses]

2-Phenyl-2-propanol is an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuff.
[Definition]

ChEBI: A tertiary alcohol that is isopropanol in which the hydrogen attached to the carbon bearing the hydroxy group has been replaced by a phenyl group.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 25, p. 1000, 1960 DOI: 10.1021/jo01076a035
Tetrahedron Letters, 22, p. 2191, 1981 DOI: 10.1016/S0040-4039(01)90495-2
[Flammability and Explosibility]

Notclassified
Spectrum DetailBack Directory
[Spectrum Detail]

2-PHENYL-2-PROPANOL(617-94-7)MS
2-PHENYL-2-PROPANOL(617-94-7)1HNMR
2-PHENYL-2-PROPANOL(617-94-7)13CNMR
2-PHENYL-2-PROPANOL(617-94-7)IR1
2-PHENYL-2-PROPANOL(617-94-7)IR2
2-PHENYL-2-PROPANOL(617-94-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Phenyl-2-propanol, 99%(617-94-7)
[Alfa Aesar]

2-Phenyl-2-propanol, 98+%(617-94-7)
[Sigma Aldrich]

617-94-7(sigmaaldrich)
[TCI AMERICA]

2-Phenyl-2-propanol,>97.0%(GC)(617-94-7)
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