ChemSpider 2D Image | 1-(2-Iodo-5-nitrophenyl)-3-oxocyclobutanecarboxylic acid | C11H8INO5

1-(2-Iodo-5-nitrophenyl)-3-oxocyclobutanecarboxylic acid

  • Molecular FormulaC11H8INO5
  • Average mass361.089 Da
  • Monoisotopic mass360.944702 Da
  • ChemSpider ID98421681

More details:

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

1-(2-Iod-5-nitrophenyl)-3-oxocyclobutancarbonsäure [German] [ACD/IUPAC Name]
1-(2-Iodo-5-nitrophenyl)-3-oxocyclobutanecarboxylic acid [ACD/IUPAC Name]
Acide 1-(2-iodo-5-nitrophényl)-3-oxocyclobutanecarboxylique [French] [ACD/IUPAC Name]
Cyclobutanecarboxylic acid, 1-(2-iodo-5-nitrophenyl)-3-oxo- [ACD/Index Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 528.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 273.1±30.1 °C
Index of Refraction: 1.705
Molar Refractivity: 68.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.57
ACD/LogD (pH 5.5): -0.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 100 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 81.2±3.0 dyne/cm
Molar Volume: 176.3±3.0 cm3

Click to predict properties on the Chemicalize site


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