Basic information
- Name:
1,1-Diphenylethanol
- CAS No.:
599-67-7
- Molecular Structure:
- Formula:
- C14H14O
- Molecular Weight:
- 198.2604
- Synonyms:
- Benzhydrol,a-methyl- (6CI,7CI,8CI);1,1-Diphenyl-1-ethanol;Benzenemethanol, a-methyl-a-phenyl-;1-Hydroxy-1,1-diphenylethane;Diphenylmethylcarbinol;Methyldiphenylcarbinol;NSC 33;a-Methyl-a-phenylbenzenemethanol;a-Methylbenzhydrol;
- EINECS:
- 209-970-1
- Density:
- 1.079 g/cm3
- Melting Point:
- 77-81 °C(lit.)
- Boiling Point:
- 328.2 ºC at 760 mmHg
- Flash Point:
- 141.4 ºC
- Appearance:
- white to off-white powder or needles
- Safety Description:
- 24/25 Details
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Chemistry
Molecule structure of 1,1-Diphenylethanol (CAS NO.599-67-7):
IUPAC Name: 1,1-Diphenylethanol
Molecular Weight: 198.26036 g/mol
Molecular Formula: C14H14O
Melting Point: 77-81 °C(lit.)
Index of Refraction: 1.581
Molar Refractivity: 61.3 cm3
Molar Volume: 183.7 cm3
Surface Tension: 41.6 dyne/cm
Density: 1.079 g/cm3
Flash Point: 141.4 °C
Enthalpy of Vaporization: 60.22 kJ/mol
Boiling Point: 328.2 °C at 760 mmHg
Vapour Pressure: 7.79E-05 mmHg at 25 °C
XLogP3: 2.4
H-Bond Donor: 1
H-Bond Acceptor: 1
Rotatable Bond Count: 2
Exact Mass: 198.104465
MonoIsotopic Mass: 198.104465
Topological Polar Surface Area: 20.2
Heavy Atom Count: 15
Canonical SMILES: CC(C1=CC=CC=C1)(C2=CC=CC=C2)O
InChI: 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
EINECS: 209-970-1
Product Categories of 1,1-Diphenylethanol (CAS NO.599-67-7): Aromatic alcohols and diols
Safety Profile
Safety Statements: 24/25
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
Specification
1,1-Diphenylethanol (CAS NO.599-67-7) is also named as 1,1-Diphenyl-1-ethanol ; AI3-05842 ; Diphenylmethylcarbinol ; Methyldiphenylcarbinol ; NSC 33 ; alpha-Methylbenzhydrol ; Benzenemethanol, alpha-methyl-alpha-phenyl- ; Benzhydrol, alpha-methyl- (8CI) ; alpha-Methylbenzhydryl alcohol . 1,1-Diphenylethanol (CAS NO.599-67-7) is white to off-white powder or needles.
