ChemSpider 2D Image | (4R,5R)-2-Amino-4-(hydroxymethyl)-4,5-dihydro-1H-imidazole-5-carboxylic acid | C5H9N3O3

(4R,5R)-2-Amino-4-(hydroxymethyl)-4,5-dihydro-1H-imidazole-5-carboxylic acid

  • Molecular FormulaC5H9N3O3
  • Average mass159.143 Da
  • Monoisotopic mass159.064392 Da
  • ChemSpider ID61683808

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R,5R)-2-Amino-4-(hydroxymethyl)-4,5-dihydro-1H-imidazol-5-carbonsäure [German] [ACD/IUPAC Name]
(4R,5R)-2-Amino-4-(hydroxymethyl)-4,5-dihydro-1H-imidazole-5-carboxylic acid [ACD/IUPAC Name]
1H-Imidazole-5-carboxylic acid, 2-amino-4,5-dihydro-4-(hydroxymethyl)-, (4R,5R)- [ACD/Index Name]
Acide (4R,5R)-2-amino-4-(hydroxyméthyl)-4,5-dihydro-1H-imidazole-5-carboxylique [French] [ACD/IUPAC Name]
2090327-83-4 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 444.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±6.0 kJ/mol
Flash Point: 222.8±31.5 °C
Index of Refraction: 1.750
Molar Refractivity: 33.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -2.61
ACD/LogD (pH 5.5): -4.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 108 Å2
Polarizability: 13.3±0.5 10-24cm3
Surface Tension: 93.2±7.0 dyne/cm
Molar Volume: 82.5±7.0 cm3

Click to predict properties on the Chemicalize site


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