ChemSpider 2D Image | (2S)-2-Acetamido-3-(1H-imidazol-4-yl)propanoate | C8H10N3O3

(2S)-2-Acetamido-3-(1H-imidazol-4-yl)propanoate

  • Molecular FormulaC8H10N3O3
  • Average mass196.184 Da
  • Monoisotopic mass196.072769 Da
  • ChemSpider ID26330909

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Acetamido-3-(1H-imidazol-4-yl)propanoat [German] [ACD/IUPAC Name]
(2S)-2-Acetamido-3-(1H-imidazol-4-yl)propanoate [ACD/IUPAC Name]
(2S)-2-Acétamido-3-(1H-imidazol-4-yl)propanoate [French] [ACD/IUPAC Name]
L-Histidine, N-acetyl-, ion(1-) [ACD/Index Name]
N(2)-acetyl-L-histidinate
N(α)-acetyl-L-histidine
N-acetyl-L-histidinate
N-acetyl-L-histidinate anion
N-Acetyl-L-histidine [ACD/IUPAC Name]
N-acetyl-L-histidine(1-)

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

Density:
Boiling Point: 620.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.6±3.0 kJ/mol
Flash Point: 328.9±30.1 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.60
ACD/LogD (pH 5.5): -3.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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