ChemSpider 2D Image | 7-Bromo-2,3-dihydrobenzo[d]oxazole-2-carboxylic acid | C8H6BrNO3

7-Bromo-2,3-dihydrobenzo[d]oxazole-2-carboxylic acid

  • Molecular FormulaC8H6BrNO3
  • Average mass244.042 Da
  • Monoisotopic mass242.953094 Da
  • ChemSpider ID28638846

More details:

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

1211597-12-4 [RN]
2-Benzoxazolecarboxylic acid, 7-bromo-2,3-dihydro- [ACD/Index Name]
7-Brom-2,3-dihydro-1,3-benzoxazol-2-carbonsäure [German] [ACD/IUPAC Name]
7-Bromo-2,3-dihydro-1,3-benzoxazole-2-carboxylic acid [ACD/IUPAC Name]
7-Bromo-2,3-dihydrobenzo[d]oxazole-2-carboxylic acid
Acide 7-bromo-2,3-dihydro-1,3-benzoxazole-2-carboxylique [French] [ACD/IUPAC Name]
1822512-15-1 [RN]
7-Bromo-2,3-dihydrobenzo[d]oxazole-2-carboxylicacid
MFCD14705075
MFCD26406250

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

Density: 1.8±0.1 g/cm3
Boiling Point: 428.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.0±3.0 kJ/mol
Flash Point: 212.7±28.7 °C
Index of Refraction: 1.634
Molar Refractivity: 48.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.51
ACD/LogD (pH 5.5): -1.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 59 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 59.5±3.0 dyne/cm
Molar Volume: 134.0±3.0 cm3

Click to predict properties on the Chemicalize site


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