Found 329 results

Search term: MF = 'C_{13}H_{8}BrNO'
ChemSpider 2D Image | 3-(4-Bromophenyl)-2,1-benzoxazole | C13H8BrNO

3-(4-Bromophenyl)-2,1-benzoxazole

  • Molecular FormulaC13H8BrNO
  • Average mass274.113 Da
  • Monoisotopic mass272.978912 Da
  • ChemSpider ID29365804

More details:

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

1140-36-9 [RN]
2,1-Benzisoxazole, 3-(4-bromophenyl)- [ACD/Index Name]
3-(4-bromophenyl)-2,1-Benzisoxazole
3-(4-Bromophenyl)-2,1-benzoxazole [ACD/IUPAC Name]
3-(4-Bromophényl)-2,1-benzoxazole [French] [ACD/IUPAC Name]
3-(4-Bromophenyl)benzo[c]isoxazole
3-(4-Bromphenyl)-2,1-benzoxazol [German] [ACD/IUPAC Name]
MFCD20486321

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

Density: 1.5±0.1 g/cm3
Boiling Point: 409.8±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.6±3.0 kJ/mol
Flash Point: 201.7±21.8 °C
Index of Refraction: 1.659
Molar Refractivity: 66.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.18
ACD/LogD (pH 5.5): 4.36
ACD/BCF (pH 5.5): 1209.98
ACD/KOC (pH 5.5): 5600.82
ACD/LogD (pH 7.4): 4.36
ACD/BCF (pH 7.4): 1209.98
ACD/KOC (pH 7.4): 5600.82
Polar Surface Area: 26 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 181.0±3.0 cm3

Click to predict properties on the Chemicalize site


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