ChemSpider 2D Image | 3-(2-Methyl-2-propanyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 4-chlorobenzoate | C20H23ClO4

3-(2-Methyl-2-propanyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 4-chlorobenzoate

  • Molecular FormulaC20H23ClO4
  • Average mass362.847 Da
  • Monoisotopic mass362.128479 Da
  • ChemSpider ID30657071

More details:

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

3-(2-Methyl-2-propanyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl 4-chlorobenzoate [ACD/IUPAC Name]
3-(2-Methyl-2-propanyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl-4-chlorbenzoat [German] [ACD/IUPAC Name]
4-Chlorobenzoate de 3-(2-méthyl-2-propanyl)-2-oxo-1-oxaspiro[4.5]déc-3-én-4-yle [French] [ACD/IUPAC Name]
Benzoic acid, 4-chloro-, 3-(1,1-dimethylethyl)-2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 507.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.7±3.0 kJ/mol
Flash Point: 184.9±29.1 °C
Index of Refraction: 1.566
Molar Refractivity: 95.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.30
ACD/LogD (pH 5.5): 5.18
ACD/BCF (pH 5.5): 5058.23
ACD/KOC (pH 5.5): 15592.47
ACD/LogD (pH 7.4): 5.18
ACD/BCF (pH 7.4): 5058.23
ACD/KOC (pH 7.4): 15592.47
Polar Surface Area: 53 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 47.1±5.0 dyne/cm
Molar Volume: 292.6±5.0 cm3

Click to predict properties on the Chemicalize site


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