ChemSpider 2D Image | (2S)-2-Chloro-N-{[2-(methylamino)-2-oxoethyl]carbamoyl}propanamide | C7H12ClN3O3

(2S)-2-Chloro-N-{[2-(methylamino)-2-oxoethyl]carbamoyl}propanamide

  • Molecular FormulaC7H12ClN3O3
  • Average mass221.641 Da
  • Monoisotopic mass221.056717 Da
  • ChemSpider ID62502629

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Chlor-N-{[2-(methylamino)-2-oxoethyl]carbamoyl}propanamid [German] [ACD/IUPAC Name]
(2S)-2-Chloro-N-{[2-(methylamino)-2-oxoethyl]carbamoyl}propanamide [ACD/IUPAC Name]
(2S)-2-Chloro-N-{[2-(méthylamino)-2-oxoéthyl]carbamoyl}propanamide [French] [ACD/IUPAC Name]
Propanamide, 2-chloro-N-[[[2-(methylamino)-2-oxoethyl]amino]carbonyl]-, (2S)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.489
Molar Refractivity: 50.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.17
ACD/LogD (pH 5.5): -0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.94
ACD/LogD (pH 7.4): -0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.56
Polar Surface Area: 87 Å2
Polarizability: 19.9±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 173.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement