ChemSpider 2D Image | (3R)-3-Amino-3-phenylpropanenitrile | C9H10N2

(3R)-3-Amino-3-phenylpropanenitrile

  • Molecular FormulaC9H10N2
  • Average mass146.189 Da
  • Monoisotopic mass146.084396 Da
  • ChemSpider ID28190225

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Amino-3-phenylpropanenitrile [ACD/IUPAC Name]
(3R)-3-Amino-3-phénylpropanenitrile [French] [ACD/IUPAC Name]
(3R)-3-Amino-3-phenylpropannitril [German] [ACD/IUPAC Name]
Benzenepropanenitrile, β-amino-, (βR)- [ACD/Index Name]
(R)-3-amino-3-phenylpropanenitrile
1240591-16-5 [RN]
MFCD06761871

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

Density: 1.1±0.1 g/cm3
Boiling Point: 316.5±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.8±3.0 kJ/mol
Flash Point: 145.2±22.3 °C
Index of Refraction: 1.556
Molar Refractivity: 43.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.79
ACD/LogD (pH 5.5): -0.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.63
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 2.39
ACD/KOC (pH 7.4): 60.83
Polar Surface Area: 50 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 136.6±3.0 cm3

Click to predict properties on the Chemicalize site


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