ChemSpider 2D Image | (3beta,4alpha,5alpha,24Z)-3-Hydroxystigmasta-7,24(28)-diene-4-carboxylate | C30H47O3

(3β,4α,5α,24Z)-3-Hydroxystigmasta-7,24(28)-diene-4-carboxylate

  • Molecular FormulaC30H47O3
  • Average mass455.693 Da
  • Monoisotopic mass455.353058 Da
  • ChemSpider ID128920446

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3β,4α,5α,24Z)-3-Hydroxystigmasta-7,24(28)-dien-4-carboxylat [German] [ACD/IUPAC Name]
(3β,4α,5α,24Z)-3-Hydroxystigmasta-7,24(28)-diene-4-carboxylate [ACD/IUPAC Name]
(3β,4α,5α,24Z)-3-Hydroxystigmasta-7,24(28)-diène-4-carboxylate [French] [ACD/IUPAC Name]
Stigmasta-7,24(28)-diene-4-carboxylic acid, 3-hydroxy-, ion(1-), (3β,4α,5α,24Z)- [ACD/Index Name]
4&α
-ol

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

Density:
Boiling Point: 573.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.7±6.0 kJ/mol
Flash Point: 314.6±26.6 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 9.30
ACD/LogD (pH 5.5): 6.58
ACD/BCF (pH 5.5): 28430.19
ACD/KOC (pH 5.5): 22748.27
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 478.12
ACD/KOC (pH 7.4): 382.57
Polar Surface Area: 60 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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