ChemSpider 2D Image | 3,3-dimethylcyclobutene-1-carboxylate | C7H9O2

3,3-dimethylcyclobutene-1-carboxylate

  • Molecular FormulaC7H9O2
  • Average mass125.146 Da
  • Monoisotopic mass125.060806 Da
  • ChemSpider ID24771523
  • Charge - Charge


More details:






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

1-Cyclobutene-1-carboxylic acid, 3,3-dimethyl-, ion(1-) [ACD/Index Name]
3,3-Dimethyl-1-cyclobuten-1-carboxylat [German] [ACD/IUPAC Name]
3,3-Dimethyl-1-cyclobutene-1-carboxylate [ACD/IUPAC Name]
3,3-Diméthyl-1-cyclobutène-1-carboxylate [French] [ACD/IUPAC Name]
3,3-dimethylcyclobutene-1-carboxylate

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

Density:
Boiling Point: 207.6±19.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.8 mmHg at 25°C
Enthalpy of Vaporization: 48.9±6.0 kJ/mol
Flash Point: 95.4±16.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 3.30
ACD/KOC (pH 5.5): 55.81
ACD/LogD (pH 7.4): -0.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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