ChemSpider 2D Image | (1R,2R)-2-[(4-Pyridinylmethyl)carbamoyl]cyclopropanecarboxylic acid | C11H12N2O3

(1R,2R)-2-[(4-Pyridinylmethyl)carbamoyl]cyclopropanecarboxylic acid

  • Molecular FormulaC11H12N2O3
  • Average mass220.225 Da
  • Monoisotopic mass220.084793 Da
  • ChemSpider ID70676299

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,2R)-2-[(4-Pyridinylmethyl)carbamoyl]cyclopropancarbonsäure [German] [ACD/IUPAC Name]
(1R,2R)-2-[(4-Pyridinylmethyl)carbamoyl]cyclopropanecarboxylic acid [ACD/IUPAC Name]
Acide (1R,2R)-2-[(4-pyridinylméthyl)carbamoyl]cyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 2-[[(4-pyridinylmethyl)amino]carbonyl]-, (1R,2R)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 559.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 292.2±30.1 °C
Index of Refraction: 1.610
Molar Refractivity: 55.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.52
ACD/LogD (pH 5.5): -1.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 79 Å2
Polarizability: 21.9±0.5 10-24cm3
Surface Tension: 70.2±3.0 dyne/cm
Molar Volume: 159.5±3.0 cm3

Click to predict properties on the Chemicalize site


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