ChemSpider 2D Image | cis-4-Cyano-4-(1-cyclohexyl-3-ethyl-1H-indazol-6-yl)cyclohexanecarboxylic acid | C23H29N3O2

cis-4-Cyano-4-(1-cyclohexyl-3-ethyl-1H-indazol-6-yl)cyclohexanecarboxylic acid

  • Molecular FormulaC23H29N3O2
  • Average mass379.495 Da
  • Monoisotopic mass379.225983 Da
  • ChemSpider ID29786983

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Acide cis-4-cyano-4-(1-cyclohexyl-3-éthyl-1H-indazol-6-yl)cyclohexanecarboxylique [French] [ACD/IUPAC Name]
cis-4-Cyan-4-(1-cyclohexyl-3-ethyl-1H-indazol-6-yl)cyclohexancarbonsäure [German] [ACD/IUPAC Name]
cis-4-Cyano-4-(1-cyclohexyl-3-ethyl-1H-indazol-6-yl)cyclohexanecarboxylic acid [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 4-cyano-4-(1-cyclohexyl-3-ethyl-1H-indazol-6-yl)-, cis- [ACD/Index Name]
199171-88-5 [RN]
CP-401387

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

Density: 1.3±0.1 g/cm3
Boiling Point: 615.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.0±3.0 kJ/mol
Flash Point: 326.2±31.5 °C
Index of Refraction: 1.649
Molar Refractivity: 109.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.83
ACD/LogD (pH 5.5): 3.59
ACD/BCF (pH 5.5): 173.33
ACD/KOC (pH 5.5): 683.43
ACD/LogD (pH 7.4): 1.79
ACD/BCF (pH 7.4): 2.75
ACD/KOC (pH 7.4): 10.85
Polar Surface Area: 79 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 51.3±7.0 dyne/cm
Molar Volume: 300.0±7.0 cm3

Click to predict properties on the Chemicalize site


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