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Search term: MF = 'C_{16}H_{19}BrO_{4}'
ChemSpider 2D Image | 3-Cyclohexen-1-ylmethyl 4-bromo-3,5-dimethoxybenzoate | C16H19BrO4

3-Cyclohexen-1-ylmethyl 4-bromo-3,5-dimethoxybenzoate

  • Molecular FormulaC16H19BrO4
  • Average mass355.224 Da
  • Monoisotopic mass354.046661 Da
  • ChemSpider ID31514092

More details:

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

3-Cyclohexen-1-ylmethyl 4-bromo-3,5-dimethoxybenzoate [ACD/IUPAC Name]
3-Cyclohexen-1-ylmethyl-4-brom-3,5-dimethoxybenzoat [German] [ACD/IUPAC Name]
4-Bromo-3,5-diméthoxybenzoate de 3-cyclohexén-1-ylméthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-bromo-3,5-dimethoxy-, 3-cyclohexen-1-ylmethyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 446.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 223.9±27.3 °C
Index of Refraction: 1.544
Molar Refractivity: 84.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 4.18
ACD/BCF (pH 5.5): 882.20
ACD/KOC (pH 5.5): 4467.23
ACD/LogD (pH 7.4): 4.18
ACD/BCF (pH 7.4): 882.20
ACD/KOC (pH 7.4): 4467.23
Polar Surface Area: 45 Å2
Polarizability: 33.4±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 267.3±3.0 cm3

Click to predict properties on the Chemicalize site


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