ChemSpider 2D Image | 1-Chloro-2,2-propanediol | C3H7ClO2

1-Chloro-2,2-propanediol

  • Molecular FormulaC3H7ClO2
  • Average mass110.539 Da
  • Monoisotopic mass110.013458 Da
  • ChemSpider ID32995067

More details:

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

1-Chlor-2,2-propandiol [German] [ACD/IUPAC Name]
1-Chloro-2,2-propanediol [ACD/IUPAC Name]
1-Chloro-2,2-propanediol [French] [ACD/IUPAC Name]
2,2-Propanediol, 1-chloro- [ACD/Index Name]
188487-45-8 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 150.2±20.0 °C at 760 mmHg
Vapour Pressure: 1.5±0.6 mmHg at 25°C
Enthalpy of Vaporization: 45.1±6.0 kJ/mol
Flash Point: 44.6±21.8 °C
Index of Refraction: 1.476
Molar Refractivity: 23.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.69
ACD/LogD (pH 5.5): -0.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.76
ACD/LogD (pH 7.4): -0.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.76
Polar Surface Area: 40 Å2
Polarizability: 9.4±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 84.5±3.0 cm3

Click to predict properties on the Chemicalize site


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