ChemSpider 2D Image | (2S)-2-(4-Chlorophenyl)-2-butanol | C10H13ClO

(2S)-2-(4-Chlorophenyl)-2-butanol

  • Molecular FormulaC10H13ClO
  • Average mass184.663 Da
  • Monoisotopic mass184.065491 Da
  • ChemSpider ID74109886

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(4-Chlorophenyl)-2-butanol [ACD/IUPAC Name]
(2S)-2-(4-Chlorophényl)-2-butanol [French] [ACD/IUPAC Name]
(2S)-2-(4-Chlorphenyl)-2-butanol [German] [ACD/IUPAC Name]
Benzenemethanol, 4-chloro-α-ethyl-α-methyl-, (αS)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 267.3±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.4±3.0 kJ/mol
Flash Point: 115.5±20.4 °C
Index of Refraction: 1.529
Molar Refractivity: 51.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 95.00
ACD/KOC (pH 5.5): 906.28
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 95.00
ACD/KOC (pH 7.4): 906.28
Polar Surface Area: 20 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 165.6±3.0 cm3

Click to predict properties on the Chemicalize site


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