ChemSpider 2D Image | (1R)-1-(2-Chlorophenyl)-2,2-dimethyl-1,3-propanediol | C11H15ClO2

(1R)-1-(2-Chlorophenyl)-2,2-dimethyl-1,3-propanediol

  • Molecular FormulaC11H15ClO2
  • Average mass214.689 Da
  • Monoisotopic mass214.076050 Da
  • ChemSpider ID35519642

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-1-(2-Chlorophenyl)-2,2-dimethyl-1,3-propanediol [ACD/IUPAC Name]
(1R)-1-(2-Chlorophényl)-2,2-diméthyl-1,3-propanediol [French] [ACD/IUPAC Name]
(1R)-1-(2-Chlorphenyl)-2,2-dimethyl-1,3-propandiol [German] [ACD/IUPAC Name]
1,3-Propanediol, 1-(2-chlorophenyl)-2,2-dimethyl-, (1R)- [ACD/Index Name]
(1R)-1-(2-chlorophenyl)-2,2-dimethylpropane-1,3-diol
(R)-1-(2-Chlorophenyl)-2,2-dimethylpropane-1,3-diol
1,3-PROPANEDIOL, 1-(2-CHLOROPHENYL)-2,2-DIMETHYL-, (R)-
139406-15-8 [RN]
MFCD28976644
SS-4918

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

Density: 1.2±0.1 g/cm3
Boiling Point: 353.0±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.1±3.0 kJ/mol
Flash Point: 167.3±23.7 °C
Index of Refraction: 1.555
Molar Refractivity: 57.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 23.02
ACD/KOC (pH 5.5): 328.59
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 23.02
ACD/KOC (pH 7.4): 328.59
Polar Surface Area: 40 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 179.5±3.0 cm3

Click to predict properties on the Chemicalize site


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