ChemSpider 2D Image | methyl 2-amino-5-isobutyloxazole-4-carboxylate | C9H14N2O3

methyl 2-amino-5-isobutyloxazole-4-carboxylate

  • Molecular FormulaC9H14N2O3
  • Average mass198.219 Da
  • Monoisotopic mass198.100449 Da
  • ChemSpider ID28293730

More details:

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

1072944-88-7 [RN]
2-Amino-5-isobutyl-1,3-oxazole-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
4-Oxazolecarboxylic acid, 2-amino-5-(2-methylpropyl)-, methyl ester [ACD/Index Name]
Methyl 2-amino-5-isobutyl-1,3-oxazole-4-carboxylate [ACD/IUPAC Name]
methyl 2-amino-5-isobutyloxazole-4-carboxylate
Methyl-2-amino-5-isobutyl-1,3-oxazol-4-carboxylat [German] [ACD/IUPAC Name]
[1072944-88-7] [RN]
HI-1443
Methyl 2-amino-5-(2-methylpropyl)-1,3-oxazole-4-carboxylate
methyl-2-amino-5-isobutyloxazole-4-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 333.4±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.6±3.0 kJ/mol
Flash Point: 155.4±28.4 °C
Index of Refraction: 1.510
Molar Refractivity: 51.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.67
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 8.85
ACD/KOC (pH 5.5): 165.58
ACD/LogD (pH 7.4): 1.55
ACD/BCF (pH 7.4): 8.90
ACD/KOC (pH 7.4): 166.37
Polar Surface Area: 78 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 171.8±3.0 cm3

Click to predict properties on the Chemicalize site


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