ChemSpider 2D Image | MFCD03939905 | C6H11NO3

MFCD03939905

  • Molecular FormulaC6H11NO3
  • Average mass145.156 Da
  • Monoisotopic mass145.073898 Da
  • ChemSpider ID21502687

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(acetylamino)butanoic acid|L-2-ACETAMIDOBUTYRIC ACID
(2S)-2-Acetamidobutanoic acid [ACD/IUPAC Name]
(2S)-2-Acetamidobutansäure [German] [ACD/IUPAC Name]
Acide (2S)-2-acétamidobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2-(acetylamino)-, (2S)- [ACD/Index Name]
MFCD03939905
(2S)-2-(acetylamino)butanoic acid
19146-51-1 [RN]
Butanoic acid, 2-(acetylamino)-, (S)-
BUTANOIC ACID, 2-(ACETYLAMINO)-,(2S)-
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 368.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 67.5±6.0 kJ/mol
Flash Point: 176.5±23.2 °C
Index of Refraction: 1.457
Molar Refractivity: 35.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.53
ACD/LogD (pH 5.5): -3.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 13.9±0.5 10-24cm3
Surface Tension: 39.9±3.0 dyne/cm
Molar Volume: 128.5±3.0 cm3

Click to predict properties on the Chemicalize site


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