ChemSpider 2D Image | (2Z)-3-(1H-Imidazol-4-yl)-2-propen-1-amine | C6H9N3

(2Z)-3-(1H-Imidazol-4-yl)-2-propen-1-amine

  • Molecular FormulaC6H9N3
  • Average mass123.156 Da
  • Monoisotopic mass123.079643 Da
  • ChemSpider ID23201722

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-(1H-Imidazol-4-yl)-2-propen-1-amin [German] [ACD/IUPAC Name]
(2Z)-3-(1H-Imidazol-4-yl)-2-propen-1-amine [ACD/IUPAC Name]
(2Z)-3-(1H-Imidazol-4-yl)-2-propén-1-amine [French] [ACD/IUPAC Name]
(2Z)-3-(1H-imidazol-4-yl)prop-2-en-1-amine
2-Propen-1-amine, 3-(1H-imidazol-4-yl)-, (2Z)- [ACD/Index Name]
(Z)-3-(1H-Imidazol-4-yl)-allylamine
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL330979/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 400.5±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.1±3.0 kJ/mol
Flash Point: 224.8±12.6 °C
Index of Refraction: 1.643
Molar Refractivity: 38.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.95
ACD/LogD (pH 5.5): -3.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 55 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 105.6±3.0 cm3

Click to predict properties on the Chemicalize site


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