ChemSpider 2D Image | (3alpha,5beta,17beta)-4-Chloro-17-(hydroxymethyl)-10,17-dimethylgon-13-en-3-ol | C20H31ClO2

(3α,5β,17β)-4-Chloro-17-(hydroxymethyl)-10,17-dimethylgon-13-en-3-ol

  • Molecular FormulaC20H31ClO2
  • Average mass338.912 Da
  • Monoisotopic mass338.201263 Da
  • ChemSpider ID107444902

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(3α,5β,17β)-4-Chlor-17-(hydroxymethyl)-10,17-dimethylgon-13-en-3-ol [German] [ACD/IUPAC Name]
(3α,5β,17β)-4-Chloro-17-(hydroxymethyl)-10,17-dimethylgon-13-en-3-ol [ACD/IUPAC Name]
(3α,5β,17β)-4-Chloro-17-(hydroxyméthyl)-10,17-diméthylgon-13-én-3-ol [French] [ACD/IUPAC Name]
Gon-13-en-3-ol, 4-chloro-17-(hydroxymethyl)-10,17-dimethyl-, (3α,5β,17β)- [ACD/Index Name]
1372695-72-1 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 481.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 86.0±6.0 kJ/mol
Flash Point: 245.1±28.7 °C
Index of Refraction: 1.571
Molar Refractivity: 93.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 4.39
ACD/BCF (pH 5.5): 1271.41
ACD/KOC (pH 5.5): 5802.91
ACD/LogD (pH 7.4): 4.39
ACD/BCF (pH 7.4): 1271.41
ACD/KOC (pH 7.4): 5802.91
Polar Surface Area: 40 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 47.3±5.0 dyne/cm
Molar Volume: 285.5±5.0 cm3

Click to predict properties on the Chemicalize site


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