Found 7 results

Search term: KIULDMFHZZHYKZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3alpha,8alpha,9beta,10alpha,13alpha,14beta,17alpha,20S)-Cholesta-4,6-dien-3-ol | C27H44O

(3α,8α,9β,10α,13α,14β,17α,20S)-Cholesta-4,6-dien-3-ol

  • Molecular FormulaC27H44O
  • Average mass384.638 Da
  • Monoisotopic mass384.339203 Da
  • ChemSpider ID64872741

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(3α,8α,9β,10α,13α,14β,17α,20S)-Cholesta-4,6-dien-3-ol [German] [ACD/IUPAC Name]
(3α,8α,9β,10α,13α,14β,17α,20S)-Cholesta-4,6-dien-3-ol [ACD/IUPAC Name]
(3α,8α,9β,10α,13α,14β,17α,20S)-Cholesta-4,6-dién-3-ol [French] [ACD/IUPAC Name]
Cholesta-4,6-dien-3-ol, (3α,8α,9β,10α,13α,14β,17α,20S)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 492.9±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.5±6.0 kJ/mol
Flash Point: 212.1±12.4 °C
Index of Refraction: 1.536
Molar Refractivity: 119.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 9.40
ACD/LogD (pH 5.5): 7.60
ACD/BCF (pH 5.5): 353361.88
ACD/KOC (pH 5.5): 325828.13
ACD/LogD (pH 7.4): 7.60
ACD/BCF (pH 7.4): 353361.88
ACD/KOC (pH 7.4): 325828.13
Polar Surface Area: 20 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 38.8±5.0 dyne/cm
Molar Volume: 384.8±5.0 cm3

Click to predict properties on the Chemicalize site


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