ChemicalBook--->CAS DataBase List--->93-54-9

93-54-9

93-54-9 Structure

93-54-9 Structure
IdentificationMore
[Name]

1-Phenyl-1-propanol
[CAS]

93-54-9
[Synonyms]

(+/-)-1-PHENYL-1-PROPANOL
1-PHENYL-1-PROPANOL
(+/-)-1-PHENYLPROPANOL
1-PHENYLPROPYL ALCOHOL
A-ETHYLBENZYL ALCOHOL
(+/-)-ALPHA-ETHYLBENZYL ALCOHOL
ALPHA-ETHYLBENZYL ALCOHOL
ALPHA-PHENYLPROPYL ALCOHOL
AURORA KA-6948
ETHYLPHENYLCARBINOL
FEMA 2884
PHENYL ETHYL CARBINOL
.alpha.-Ethylbenzenemethanol
.alpha.-Hydroxypropylbenzene
1-Phenyl-1-Hydroxypropane
1-Phenyl-n-propanol
1-phenyl-propan-1-ol
1-Phenylpropan-1-ol
1-Propanol, 1-phenyl-
alpha.-Ethylbenzenemethanol
[EINECS(EC#)]

202-256-0
[Molecular Formula]

C9H12O
[MDL Number]

MFCD00004564
[Molecular Weight]

136.19
[MOL File]

93-54-9.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless liquid
[Boiling point ]

217-219 °C(lit.)
[density ]

0.994 g/mL at 25 °C(lit.)
[FEMA ]

2884
[refractive index ]

n20/D 1.521
[Fp ]

195 °F
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

0.62g/l
[form ]

Liquid
[pka]

14.43±0.20(Predicted)
[color ]

Clear colorless
[Odor]

at 100.00 %. sweet floral balsam
[Odor Type]

floral
[Water Solubility ]

insoluble
[JECFA Number]

822
[Merck ]

14,3768
[BRN ]

1906759
[InChIKey]

DYUQAZSOFZSPHD-UHFFFAOYSA-N
[LogP]

1.91
[CAS DataBase Reference]

93-54-9(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzenemethanol, «alpha»-ethyl-(93-54-9)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R22:Harmful if swallowed.
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
[RIDADR ]

2810
[WGK Germany ]

3
[RTECS ]

DO5470000
[HS Code ]

29062900
[Toxicity]

LD50 orally in rats: 1.6 ml/kg (Linét)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Potassium borohydride-->Propiophenone-->Silane, (1,1-dimethylethyl)dimethyl(1-phenylpropoxy)--->1-Phenyl-2-propyn-1-one-->Diethylzinc-->3-Phenylpropene-3-ol-->Acetone-->Propionaldehyde-->Ethylmagnesium bromide-->Isopropyl alcohol-->1-PHENYL-2-PROPYN-1-OL-->Bromobenzene-->Benzaldehyde-->Triethylborane-->N-PROPYLBENZENE-->1-Phenylpropan-1-amine
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

alpha-Ethylbenzyl alcohol(93-54-9).msds
Hazard InformationBack Directory
[Chemical Properties]

1-Phenyl-1-propanal has a balsamic, floral fragrance and a sweet, honey-like taste.
[Chemical Properties]

clear colorless liquid
[Occurrence]

Reported found in Bantu beer.
[Uses]

As heat transfer medium; in perfumery.
[Definition]

ChEBI:Phenylpropanol is an organic molecular entity.
[Preparation]

By hydrogenation of phenethyl ketone.
[Synthesis Reference(s)]

Tetrahedron, 50, p. 3427, 1994 DOI: 10.1016/S0040-4020(01)87022-8
[General Description]

1-Phenyl-1-propanol enantiomers (E-PP) forms the inclusion complexes of cyclic decapeptide (CDP) which were studied using the density functional theory (DFT) B3LYP method. It was also used to determine the mass transfer kinetics effect on the elution profiles of the 1-phenyl-1-propanol (PP) enantiomers on Chiracel OB (cellulose tribenzoate coated on silica gel).
Spectrum DetailBack Directory
[Spectrum Detail]

1-Phenyl-1-propanol(93-54-9)MS
1-Phenyl-1-propanol(93-54-9)1HNMR
1-Phenyl-1-propanol(93-54-9)13CNMR
1-Phenyl-1-propanol(93-54-9)IR1
1-Phenyl-1-propanol(93-54-9)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Phenyl-1-propanol, 99%(93-54-9)
[Alfa Aesar]

(+/-)-1-Phenyl-1-propanol, 98+%(93-54-9)
[Sigma Aldrich]

93-54-9(sigmaaldrich)
[TCI AMERICA]

1-Phenyl-1-propanol,>97.0%(GC)(93-54-9)
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