ChemSpider 2D Image | (2S)-4-(2-Amino-1H-imidazol-4-yl)-2-ammoniobutanoate | C7H12N4O2

(2S)-4-(2-Amino-1H-imidazol-4-yl)-2-ammoniobutanoate

  • Molecular FormulaC7H12N4O2
  • Average mass184.196 Da
  • Monoisotopic mass184.096024 Da
  • ChemSpider ID24672315

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-4-(2-Amino-1H-imidazol-4-yl)-2-ammoniobutanoat [German] [ACD/IUPAC Name]
(2S)-4-(2-Amino-1H-imidazol-4-yl)-2-ammoniobutanoate [ACD/IUPAC Name]
(2S)-4-(2-Amino-1H-imidazol-4-yl)-2-ammoniobutanoate [French] [ACD/IUPAC Name]
1H-Imidazole-4-butanoic acid, α,2-diamino-, (αS)- [ACD/Index Name]
Z70

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

Density:
Boiling Point: 495.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.4±3.0 kJ/mol
Flash Point: 253.7±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.28
ACD/LogD (pH 5.5): -4.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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