ChemSpider 2D Image | (2S)-1-Chloro-3-isopropoxy-2-propanol | C6H13ClO2

(2S)-1-Chloro-3-isopropoxy-2-propanol

  • Molecular FormulaC6H13ClO2
  • Average mass152.619 Da
  • Monoisotopic mass152.060410 Da
  • ChemSpider ID32995241

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-Chlor-3-isopropoxy-2-propanol [German] [ACD/IUPAC Name]
(2S)-1-Chloro-3-isopropoxy-2-propanol [ACD/IUPAC Name]
(2S)-1-Chloro-3-isopropoxy-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-chloro-3-(1-methylethoxy)-, (2S)- [ACD/Index Name]
890051-51-1 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 212.4±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 52.2±6.0 kJ/mol
Flash Point: 82.3±21.8 °C
Index of Refraction: 1.441
Molar Refractivity: 37.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.78
ACD/LogD (pH 5.5): 0.89
ACD/BCF (pH 5.5): 2.80
ACD/KOC (pH 5.5): 72.68
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 2.80
ACD/KOC (pH 7.4): 72.68
Polar Surface Area: 29 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 31.6±3.0 dyne/cm
Molar Volume: 143.6±3.0 cm3

Click to predict properties on the Chemicalize site


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