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599-67-7

599-67-7 Structure

599-67-7 Structure
IdentificationMore
[Name]

1,1-DIPHENYLETHANOL
[CAS]

599-67-7
[Synonyms]

1,1-DIPHENYLETHANOL
ALPHA-METHYLBENZHYDROL
METHYL DIPHENYL CARBINOL
1,1-Diphenyl-1-ethanol
alpha-methyl-alpha-phenyl-benzenemethano
Benzhydrol, alpha-methyl-
Diphenylmethylcarbinol
alpha-Methylbenzhydrol~Methyl diphenyl carbinol
alpha-methylbenzhydryl alcohol
1,1-Diphenylethanol,98%
à-methylbenzhydrol
α-methylbenzhydrol
α-Methylbenzhydol
α-Methylbenzhydryl alcohol
α-Methyl-α-phenylbenzenemethanol
[EINECS(EC#)]

209-970-1
[Molecular Formula]

C14H14O
[MDL Number]

MFCD00004450
[Molecular Weight]

198.26
[MOL File]

599-67-7.mol
Chemical PropertiesBack Directory
[Appearance]

white to off-white powder or needles
[Melting point ]

77-81 °C (lit.)
[Boiling point ]

155 °C / 12mmHg
[density ]

1.0074 (rough estimate)
[refractive index ]

1.5381 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

13.61±0.29(Predicted)
[color ]

White to Light yellow
[BRN ]

1867726
[InChI]

1S/C14H14O/c1-14(15,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,15H,1H3
[InChIKey]

GIMDPFBLSKQRNP-UHFFFAOYSA-N
[SMILES]

CC(O)(c1ccccc1)c2ccccc2
[LogP]

2.904 (est)
[CAS DataBase Reference]

599-67-7(CAS DataBase Reference)
[NIST Chemistry Reference]

Benzenemethanol, «alpha»-methyl-«alpha»-phenyl-(599-67-7)
[EPA Substance Registry System]

599-67-7(EPA Substance)
Safety DataBack Directory
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[TSCA ]

TSCA listed
[HS Code ]

29062990
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

white to off-white powder or needles
[Uses]

1,1-Diphenylethanol was used to study the ESR spectra of the spiro-cyclohexadienyl intermediate in the alkoxyl radicals.
[General Description]

The H-bonds in 1,1-diphenylethanol were studied by means of infrared (IR) absorption spectra.
[Purification Methods]

Crystallise 1,1-diphenylethanol from n-heptane and/or distil it under vacuum. The benzoyl derivative has m 115o and the phenylurethane has m 119o. [Bromberg et al. J Am Chem Soc 107 83 1985, Beilstein 6 H 685, 6 I 330, 6 II 639, 6 III 3395, 6 IV 4713.]
Spectrum DetailBack Directory
[Spectrum Detail]

1,1-DIPHENYLETHANOL(599-67-7)MS
1,1-DIPHENYLETHANOL(599-67-7)1HNMR
1,1-DIPHENYLETHANOL(599-67-7)13CNMR
1,1-DIPHENYLETHANOL(599-67-7)IR1
1,1-DIPHENYLETHANOL(599-67-7)IR2
1,1-DIPHENYLETHANOL(599-67-7)IR3
1,1-DIPHENYLETHANOL(599-67-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1,1-Diphenylethanol, 98+%(599-67-7)
[Alfa Aesar]

1,1-Diphenylethanol, 98+%(599-67-7)
[Sigma Aldrich]

599-67-7(sigmaaldrich)
[TCI AMERICA]

1,1-Diphenylethanol,>98.0%(GC)(599-67-7)
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