Found 8 results

Search term: LVYGYHKQJHFGNS (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (3Z,8alpha,9beta,10alpha)-3-(Hydroxyimino)cholest-4-en-6-one | C27H43NO2

(3Z,8α,9β,10α)-3-(Hydroxyimino)cholest-4-en-6-one

  • Molecular FormulaC27H43NO2
  • Average mass413.636 Da
  • Monoisotopic mass413.329376 Da
  • ChemSpider ID62552583

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(3Z,8α,9β,10α)-3-(Hydroxyimino)cholest-4-en-6-on [German] [ACD/IUPAC Name]
(3Z,8α,9β,10α)-3-(Hydroxyimino)cholest-4-en-6-one [ACD/IUPAC Name]
(3Z,8α,9β,10α)-3-(Hydroxyimino)cholest-4-én-6-one [French] [ACD/IUPAC Name]
(3Z,8α,9β,10α,14β)-3-(Hydroxyimino)cholest-4-en-6-on [German] [ACD/IUPAC Name]
(3Z,8α,9β,10α,14β)-3-(Hydroxyimino)cholest-4-en-6-one [ACD/IUPAC Name]
(3Z,8α,9β,10α,14β)-3-(Hydroxyimino)cholest-4-én-6-one [French] [ACD/IUPAC Name]
Cholest-4-ene-3,6-dione, 3-oxime, (3Z,8α,9β,10α)- [ACD/Index Name]
Cholest-4-ene-3,6-dione, 3-oxime, (3Z,8α,9β,10α,14β)- [ACD/Index 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: 530.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.7±6.0 kJ/mol
Flash Point: 274.8±25.4 °C
Index of Refraction: 1.594
Molar Refractivity: 121.7±0.5 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 8.10
ACD/LogD (pH 5.5): 7.20
ACD/BCF (pH 5.5): 174983.53
ACD/KOC (pH 5.5): 197020.23
ACD/LogD (pH 7.4): 7.20
ACD/BCF (pH 7.4): 174678.52
ACD/KOC (pH 7.4): 196676.81
Polar Surface Area: 50 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 39.9±7.0 dyne/cm
Molar Volume: 358.6±7.0 cm3

Click to predict properties on the Chemicalize site


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