ChemSpider 2D Image | 4-{[(3-Amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]amino}butanoic acid | C8H13N3O5S

4-{[(3-Amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]amino}butanoic acid

  • Molecular FormulaC8H13N3O5S
  • Average mass263.271 Da
  • Monoisotopic mass263.057587 Da
  • ChemSpider ID57958560

More details:

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

4-{[(3-Amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]amino}butanoic acid [ACD/IUPAC Name]
4-{[(3-Amino-5-methyl-1,2-oxazol-4-yl)sulfonyl]amino}butansäure [German] [ACD/IUPAC Name]
Acide 4-{[(3-amino-5-méthyl-1,2-oxazol-4-yl)sulfonyl]amino}butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[[(3-amino-5-methyl-4-isoxazolyl)sulfonyl]amino]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 566.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.5±3.0 kJ/mol
Flash Point: 296.3±32.9 °C
Index of Refraction: 1.561
Molar Refractivity: 57.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -1.07
ACD/LogD (pH 5.5): -1.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.05
ACD/LogD (pH 7.4): -2.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 144 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 66.8±3.0 dyne/cm
Molar Volume: 178.7±3.0 cm3

Click to predict properties on the Chemicalize site


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