ChemSpider 2D Image | 5-Bromo-3-chromanone | C9H7BrO2

5-Bromo-3-chromanone

  • Molecular FormulaC9H7BrO2
  • Average mass227.055 Da
  • Monoisotopic mass225.962936 Da
  • ChemSpider ID14067162

More details:

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

132873-53-1 [RN]
2H-1-Benzopyran-3(4H)-one, 5-bromo- [ACD/Index Name]
5-Brom-2H-chromen-3(4H)-on [German] [ACD/IUPAC Name]
5-Bromo-2H-chromen-3(4H)-one [ACD/IUPAC Name]
5-Bromo-2H-chromén-3(4H)-one [French] [ACD/IUPAC Name]
5-Bromo-3-chromanone
[132873-53-1] [RN]
5-BROMO-2,4-DIHYDRO-1-BENZOPYRAN-3-ONE
5-Bromo-2H-1-benzopyran-3(4H)-onato
5-bromo-3,4-dihydro-2H-1-benzopyran-3-one
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 339.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.2±3.0 kJ/mol
Flash Point: 158.8±27.9 °C
Index of Refraction: 1.599
Molar Refractivity: 47.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.66
ACD/KOC (pH 5.5): 431.28
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.66
ACD/KOC (pH 7.4): 431.28
Polar Surface Area: 26 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 140.0±3.0 cm3

Click to predict properties on the Chemicalize site


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