ChemSpider 2D Image | 3-(3,4-Dimethoxybenzyl)-4-methoxy-4-oxobutanoate | C14H17O6

3-(3,4-Dimethoxybenzyl)-4-methoxy-4-oxobutanoate

  • Molecular FormulaC14H17O6
  • Average mass281.282 Da
  • Monoisotopic mass281.103058 Da
  • ChemSpider ID57550018

  • Charge - Charge

More details:

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

3-(3,4-Dimethoxybenzyl)-4-methoxy-4-oxobutanoat [German] [ACD/IUPAC Name]
3-(3,4-Dimethoxybenzyl)-4-methoxy-4-oxobutanoate [ACD/IUPAC Name]
3-(3,4-Diméthoxybenzyl)-4-méthoxy-4-oxobutanoate [French] [ACD/IUPAC Name]
Butanedioic acid, 2-[(3,4-dimethoxyphenyl)methyl]-, 1-methyl ester, ion(1-) [ACD/Index Name]
105544-83-0 [RN]
3-[(3,4-Dimethoxyphenyl)methyl]-4-methoxy-4-oxobutanoate

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

Density:
Boiling Point: 426.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 155.8±22.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.67
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.45
ACD/LogD (pH 7.4): -1.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 85 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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