ChemSpider 2D Image | (5beta,8alpha,9beta,10alpha,13alpha)-13-Hydroxy(17-~13~C,17,17-~2~H_2_)kaur-16-en-18-oic acid | C1913CH28D2O3

(5β,8α,9β,10α,13α)-13-Hydroxy(17-13C,17,17-2H2)kaur-16-en-18-oic acid

  • Molecular FormulaC1913CH28D2O3
  • Average mass321.455 Da
  • Monoisotopic mass321.235413 Da
  • ChemSpider ID58784391

  • defined stereocentres - 6 of 6 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(5β,8α,9β,10α,13α)-13-Hydroxy(17-13C,17,17-2H2)kaur-16-en-18-oic acid [ACD/IUPAC Name]
(5β,8α,9β,10α,13α)-13-Hydroxy(17-13C,17,17-2H2)kaur-16-en-18-säure [German] [ACD/IUPAC Name]
Acide (5β,8α,9β,10α,13α)-13-hydroxy(17-13C,17,17-2H2)kaur-16-én-18-oïque [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.569
Molar Refractivity: 89.2±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 48.7±5.0 dyne/cm
Molar Volume: 272.1±5.0 cm3

Click to predict properties on the Chemicalize site


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