ChemSpider 2D Image | 4-(2,2-Dimethylcyclobutyl)benzoic acid | C13H16O2

4-(2,2-Dimethylcyclobutyl)benzoic acid

  • Molecular FormulaC13H16O2
  • Average mass204.265 Da
  • Monoisotopic mass204.115036 Da
  • ChemSpider ID94288719

More details:

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

4-(2,2-Dimethylcyclobutyl)benzoesäure [German] [ACD/IUPAC Name]
4-(2,2-Dimethylcyclobutyl)benzoic acid [ACD/IUPAC Name]
Acide 4-(2,2-diméthylcyclobutyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(2,2-dimethylcyclobutyl)- [ACD/Index Name]
2470437-12-6 [RN]
MFCD32711201

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

Density: 1.1±0.1 g/cm3
Boiling Point: 324.0±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 59.7±3.0 kJ/mol
Flash Point: 153.5±16.7 °C
Index of Refraction: 1.548
Molar Refractivity: 59.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.32
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 40.68
ACD/KOC (pH 5.5): 226.30
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.50
Polar Surface Area: 37 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 43.8±3.0 dyne/cm
Molar Volume: 186.1±3.0 cm3

Click to predict properties on the Chemicalize site


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