ChemSpider 2D Image | 1,4-Dihydro-2-oxo-2H-3,1-benzoxazine-6-sulfonic acid | C8H7NO5S

1,4-Dihydro-2-oxo-2H-3,1-benzoxazine-6-sulfonic acid

  • Molecular FormulaC8H7NO5S
  • Average mass229.210 Da
  • Monoisotopic mass229.004486 Da
  • ChemSpider ID58185035

More details:






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

1,4-Dihydro-2-oxo-2H-3,1-benzoxazine-6-sulfonic acid
1955541-45-3 [RN]
2H-3,1-Benzoxazine-6-sulfonic acid, 1,4-dihydro-2-oxo- [ACD/Index Name]
2-Oxo-1,4-dihydro-2H-3,1-benzoxazin-6-sulfonsäure [German] [ACD/IUPAC Name]
2-Oxo-1,4-dihydro-2H-3,1-benzoxazine-6-sulfonic acid [ACD/IUPAC Name]
Acide 2-oxo-1,4-dihydro-2H-3,1-benzoxazine-6-sulfonique [French] [ACD/IUPAC Name]
2-oxo-2,4-dihydro-1H-3,1-benzoxazine-6-sulfonic acid
MFCD30181266

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.616
Molar Refractivity: 49.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.47
ACD/LogD (pH 5.5): -3.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 62.6±3.0 dyne/cm
Molar Volume: 142.6±3.0 cm3

Click to predict properties on the Chemicalize site






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