ChemSpider 2D Image | (2S)-2-(Chloroamino)butanoic acid | C4H8ClNO2

(2S)-2-(Chloroamino)butanoic acid

  • Molecular FormulaC4H8ClNO2
  • Average mass137.565 Da
  • Monoisotopic mass137.024353 Da
  • ChemSpider ID32992095
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2S)-2-(Chloramino)butansäure [German] [ACD/IUPAC Name]
(2S)-2-(Chloroamino)butanoic acid [ACD/IUPAC Name]
Acide (2S)-2-(chloroamino)butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2-(chloroamino)-, (2S)- [ACD/Index Name]
149881-93-6 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 241.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 52.6±6.0 kJ/mol
Flash Point: 99.6±27.9 °C
Index of Refraction: 1.469
Molar Refractivity: 30.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): -0.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 49 Å2
Polarizability: 12.1±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 109.8±3.0 cm3

Click to predict properties on the Chemicalize site






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