ChemSpider 2D Image | Abieta-8(14),9(11),12-trien-18-imidic acid | C20H29NO

Abieta-8(14),9(11),12-trien-18-imidic acid

  • Molecular FormulaC20H29NO
  • Average mass299.450 Da
  • Monoisotopic mass299.224915 Da
  • ChemSpider ID58815986

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1-Phenanthrenecarboximidic acid, 1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aS,10aR)- [ACD/Index Name]
Abieta-8(14),9(11),12-trien-18-imidic acid [ACD/IUPAC Name]
Abieta-8(14),9(11),12-trien-18-imidsäure [German] [ACD/IUPAC Name]
Acide abiéta-8(14),9(11),12-trién-18-imidique [French] [ACD/IUPAC Name]
(1R,4AS,10AR)-1,4A-DIMETHYL-7-(PROPAN-2-YL)-1,2,3,4,4A,9,10,10A-OCTAHYDROPHENANTHRENE-1-CARBOXAMIDE
(1R,4AS,10AR)-7-ISOPROPYL-1,4A-DIMETHYL-2,3,4,9,10,10A-HEXAHYDROPHENANTHRENE-1-CARBOXAMIDE
1-PHENANTHRENECARBOXAMIDE, 1,2,3,4,4A,9,10,10A-OCTAHYDRO-1,4A-DIMETHYL-7-(1-METHYLETHYL)-, (1R,4AS,10AR)-
35928-32-6 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 413.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 203.7±31.5 °C
Index of Refraction: 1.582
Molar Refractivity: 90.2±0.5 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.72
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 21.56
ACD/KOC (pH 5.5): 62.22
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 20.36
ACD/KOC (pH 7.4): 58.75
Polar Surface Area: 44 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 38.8±7.0 dyne/cm
Molar Volume: 270.3±7.0 cm3

Click to predict properties on the Chemicalize site


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