ChemSpider 2D Image | 3-Chloro-7-oxabicyclo[4.1.0]hepta-2,4-diene | C6H5ClO

3-Chloro-7-oxabicyclo[4.1.0]hepta-2,4-diene

  • Molecular FormulaC6H5ClO
  • Average mass128.556 Da
  • Monoisotopic mass128.002899 Da
  • ChemSpider ID28412068

More details:

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

3-Chlor-7-oxabicyclo[4.1.0]hepta-2,4-dien [German] [ACD/IUPAC Name]
3-Chloro-7-oxabicyclo[4.1.0]hepta-2,4-diene [ACD/IUPAC Name]
3-Chloro-7-oxabicyclo[4.1.0]hepta-2,4-diène [French] [ACD/IUPAC Name]
7-Oxabicyclo[4.1.0]hepta-2,4-diene, 3-chloro- [ACD/Index Name]
38261-64-2 [RN]
7-OXABICYCLO(4.1.0)HEPTA-2,4-DIENE, 3-CHLORO-

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

Density: 1.3±0.1 g/cm3
Boiling Point: 200.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.4 mmHg at 25°C
Enthalpy of Vaporization: 41.9±3.0 kJ/mol
Flash Point: 81.3±21.4 °C
Index of Refraction: 1.579
Molar Refractivity: 31.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): 1.04
ACD/BCF (pH 5.5): 3.64
ACD/KOC (pH 5.5): 87.82
ACD/LogD (pH 7.4): 1.04
ACD/BCF (pH 7.4): 3.64
ACD/KOC (pH 7.4): 87.82
Polar Surface Area: 13 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 37.9±5.0 dyne/cm
Molar Volume: 95.9±5.0 cm3

Click to predict properties on the Chemicalize site


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