ChemSpider 2D Image | 1-Hydroxy-2-nitrocyclohexanecarboxylic acid | C7H11NO5

1-Hydroxy-2-nitrocyclohexanecarboxylic acid

  • Molecular FormulaC7H11NO5
  • Average mass189.166 Da
  • Monoisotopic mass189.063721 Da
  • ChemSpider ID24197328

More details:

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

1-Hydroxy-2-nitrocyclohexancarbonsäure [German] [ACD/IUPAC Name]
1-Hydroxy-2-nitrocyclohexanecarboxylic acid [ACD/IUPAC Name]
Acide 1-hydroxy-2-nitrocyclohexanecarboxylique [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 1-hydroxy-2-nitro- [ACD/Index Name]
149695-77-2 [RN]
1-Hydroxy-2-nitrocyclohexane-1-carboxylic acid
CYCLOHEXANECARBOXYLIC ACID 1-HYDROXY-2-NITRO-
Cyclohexanecarboxylic acid, 1-hydroxy-2-nitro- (9CI)

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

Density: 1.4±0.1 g/cm3
Boiling Point: 411.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 76.7±6.0 kJ/mol
Flash Point: 186.4±17.2 °C
Index of Refraction: 1.545
Molar Refractivity: 41.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.25
ACD/LogD (pH 5.5): -3.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 16.5±0.5 10-24cm3
Surface Tension: 64.6±5.0 dyne/cm
Molar Volume: 131.6±5.0 cm3

Click to predict properties on the Chemicalize site


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