ChemSpider 2D Image | Amino(4-oxo-4,5-dihydro-1,2,5-oxadiazol-3-yl)acetic acid | C4H5N3O4

Amino(4-oxo-4,5-dihydro-1,2,5-oxadiazol-3-yl)acetic acid

  • Molecular FormulaC4H5N3O4
  • Average mass159.100 Da
  • Monoisotopic mass159.028000 Da
  • ChemSpider ID24672995

More details:

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

1,2,5-Oxadiazole-3-acetic acid, α-amino-4,5-dihydro-4-oxo- [ACD/Index Name]
Acide amino(4-oxo-4,5-dihydro-1,2,5-oxadiazol-3-yl)acétique [French] [ACD/IUPAC Name]
Amino(4-oxo-4,5-dihydro-1,2,5-oxadiazol-3-yl)acetic acid [ACD/IUPAC Name]
Amino(4-oxo-4,5-dihydro-1,2,5-oxadiazol-3-yl)essigsäure [German] [ACD/IUPAC Name]
1226869-73-3 [RN]
MFCD20660709

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

Density: 1.8±0.1 g/cm3
Boiling Point: 404.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 198.2±31.5 °C
Index of Refraction: 1.620
Molar Refractivity: 31.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.17
ACD/LogD (pH 5.5): -3.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 113.9±3.0 dyne/cm
Molar Volume: 89.0±3.0 cm3

Click to predict properties on the Chemicalize site


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