ChemSpider 2D Image | (1-Cyano-2-indolizinyl)methyl 4-cyanobenzoate | C18H11N3O2

(1-Cyano-2-indolizinyl)methyl 4-cyanobenzoate

  • Molecular FormulaC18H11N3O2
  • Average mass301.299 Da
  • Monoisotopic mass301.085114 Da
  • ChemSpider ID22485616

More details:

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

(1-Cyan-2-indolizinyl)methyl-4-cyanbenzoat [German] [ACD/IUPAC Name]
(1-Cyano-2-indolizinyl)methyl 4-cyanobenzoate [ACD/IUPAC Name]
4-Cyanobenzoate de (1-cyano-2-indolizinyl)méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-cyano-, (1-cyano-2-indolizinyl)methyl ester [ACD/Index Name]
(1-CYANOINDOLIZIN-2-YL)METHYL 4-CYANOBENZOATE

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.637
Molar Refractivity: 87.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.33
ACD/LogD (pH 5.5): 3.42
ACD/BCF (pH 5.5): 234.43
ACD/KOC (pH 5.5): 1730.07
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 234.43
ACD/KOC (pH 7.4): 1730.07
Polar Surface Area: 78 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 52.2±7.0 dyne/cm
Molar Volume: 244.9±7.0 cm3

Click to predict properties on the Chemicalize site


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