ChemSpider 2D Image | 3-(1-Acetyl-5-formyl-2-methyl-4,5-dihydro-1H-imidazol-4-yl)-2,3-dihydroxypropanoic acid | C10H14N2O6

3-(1-Acetyl-5-formyl-2-methyl-4,5-dihydro-1H-imidazol-4-yl)-2,3-dihydroxypropanoic acid

  • Molecular FormulaC10H14N2O6
  • Average mass258.228 Da
  • Monoisotopic mass258.085175 Da
  • ChemSpider ID26502954

More details:

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

1H-Imidazole-4-propanoic acid, 1-acetyl-5-formyl-4,5-dihydro-α,β-dihydroxy-2-methyl- [ACD/Index Name]
3-(1-Acetyl-5-formyl-2-methyl-4,5-dihydro-1H-imidazol-4-yl)-2,3-dihydroxypropanoic acid [ACD/IUPAC Name]
3-(1-Acetyl-5-formyl-2-methyl-4,5-dihydro-1H-imidazol-4-yl)-2,3-dihydroxypropansäure [German] [ACD/IUPAC Name]
Acide 3-(1-acétyl-5-formyl-2-méthyl-4,5-dihydro-1H-imidazol-4-yl)-2,3-dihydroxypropanoïque [French] [ACD/IUPAC Name]
88076-24-8 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 538.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 93.9±6.0 kJ/mol
Flash Point: 279.7±32.9 °C
Index of Refraction: 1.630
Molar Refractivity: 57.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -2.70
ACD/LogD (pH 5.5): -4.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 63.2±7.0 dyne/cm
Molar Volume: 162.6±7.0 cm3

Click to predict properties on the Chemicalize site


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