ChemSpider 2D Image | 4-[(1R)-1-Phenylethyl]-1,3-benzenediol | C14H14O2

4-[(1R)-1-Phenylethyl]-1,3-benzenediol

  • Molecular FormulaC14H14O2
  • Average mass214.260 Da
  • Monoisotopic mass214.099380 Da
  • ChemSpider ID24737883

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,3-Benzenediol, 4-[(1R)-1-phenylethyl]- [ACD/Index Name]
4-[(1R)-1-Phenylethyl]-1,3-benzenediol [ACD/IUPAC Name]
4-[(1R)-1-Phényléthyl]-1,3-benzènediol [French] [ACD/IUPAC Name]
4-[(1R)-1-Phenylethyl]-1,3-benzoldiol [German] [ACD/IUPAC Name]
85-27-8 [RN]
PHENYLETHYL RESORCINOL
UNII-G37UFG162O

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 365.1±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.5±3.0 kJ/mol
Flash Point: 175.2±15.5 °C
Index of Refraction: 1.616
Molar Refractivity: 64.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 3.08
ACD/BCF (pH 5.5): 127.92
ACD/KOC (pH 5.5): 1121.36
ACD/LogD (pH 7.4): 3.07
ACD/BCF (pH 7.4): 127.19
ACD/KOC (pH 7.4): 1115.00
Polar Surface Area: 40 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 182.9±3.0 cm3

Click to predict properties on the Chemicalize site


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