ChemSpider 2D Image | 1-(4-Amino-1,2,5-oxadiazol-3-yl)-2-bromoethanone | C4H4BrN3O2

1-(4-Amino-1,2,5-oxadiazol-3-yl)-2-bromoethanone

  • Molecular FormulaC4H4BrN3O2
  • Average mass205.997 Da
  • Monoisotopic mass204.948685 Da
  • ChemSpider ID24186610

More details:

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

1-(4-Amino-1,2,5-oxadiazol-3-yl)-2-bromethanon [German] [ACD/IUPAC Name]
1-(4-Amino-1,2,5-oxadiazol-3-yl)-2-bromoethanone [ACD/IUPAC Name]
1-(4-Amino-1,2,5-oxadiazol-3-yl)-2-bromoéthanone [French] [ACD/IUPAC Name]
Ethanone, 1-(4-amino-1,2,5-oxadiazol-3-yl)-2-bromo- [ACD/Index Name]
1-(4-Amino-1,2,5-oxadiazol-3-yl)-2-bromoethan-1-one
1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-2-BROMO-ETHANONE
172469-62-4 [RN]
3-(bromoacetyl)-4-aminofurazan
Ethanone, 1-(4-amino-1,2,5-oxadiazol-3-yl)-2-bromo- (9CI)
ETHANONE,1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-2-BROMO-
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.9±0.1 g/cm3
Boiling Point: 320.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.3±3.0 kJ/mol
Flash Point: 147.9±30.1 °C
Index of Refraction: 1.612
Molar Refractivity: 36.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 5.58
ACD/KOC (pH 5.5): 119.17
ACD/LogD (pH 7.4): 1.28
ACD/BCF (pH 7.4): 5.58
ACD/KOC (pH 7.4): 119.17
Polar Surface Area: 82 Å2
Polarizability: 14.6±0.5 10-24cm3
Surface Tension: 76.7±3.0 dyne/cm
Molar Volume: 105.7±3.0 cm3

Click to predict properties on the Chemicalize site


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