Found 1 result

Search term: 78437256 (Found by CSID)
ChemSpider 2D Image | (5alpha)-4,4,14-Trimethyl-3,7,11,12,16-pentaoxochol-8-en-24-oic acid | C27H34O7

(5α)-4,4,14-Trimethyl-3,7,11,12,16-pentaoxochol-8-en-24-oic acid

  • Molecular FormulaC27H34O7
  • Average mass470.555 Da
  • Monoisotopic mass470.230438 Da
  • ChemSpider ID78437256

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(5α)-4,4,14-Trimethyl-3,7,11,12,16-pentaoxochol-8-en-24-oic acid [ACD/IUPAC Name]
(5α)-4,4,14-Trimethyl-3,7,11,12,16-pentaoxochol-8-en-24-säure [German] [ACD/IUPAC Name]
Acide (5α)-4,4,14-triméthyl-3,7,11,12,16-pentaoxochol-8-én-24-oïque [French] [ACD/IUPAC Name]
Chol-8-en-24-oic acid, 4,4,14-trimethyl-3,7,11,12,16-pentaoxo-, (5α)- [ACD/Index Name]
LUCIDENIC ACID D

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

Density: 1.3±0.1 g/cm3
Boiling Point: 637.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 102.8±6.0 kJ/mol
Flash Point: 353.5±28.0 °C
Index of Refraction: 1.564
Molar Refractivity: 120.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.24
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 4.00
ACD/KOC (pH 5.5): 52.29
ACD/LogD (pH 7.4): -0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 370.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement