Found 1 result

Search term: 78434893 (Found by CSID)
ChemSpider 2D Image | 3-Methoxy-2-(methoxycarbonyl)-4-methyl-5-[(3-methyl-2-buten-1-yl)oxy]benzoic acid | C16H20O6

3-Methoxy-2-(methoxycarbonyl)-4-methyl-5-[(3-methyl-2-buten-1-yl)oxy]benzoic acid

  • Molecular FormulaC16H20O6
  • Average mass308.326 Da
  • Monoisotopic mass308.125977 Da
  • ChemSpider ID78434893

More details:

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

1,2-Benzenedicarboxylic acid, 3-methoxy-4-methyl-5-[(3-methyl-2-buten-1-yl)oxy]-, 2-methyl ester [ACD/Index Name]
3-Methoxy-2-(methoxycarbonyl)-4-methyl-5-[(3-methyl-2-buten-1-yl)oxy]benzoesäure [German] [ACD/IUPAC Name]
3-Methoxy-2-(methoxycarbonyl)-4-methyl-5-[(3-methyl-2-buten-1-yl)oxy]benzoic acid [ACD/IUPAC Name]
Acide 3-méthoxy-2-(méthoxycarbonyl)-4-méthyl-5-[(3-méthyl-2-butén-1-yl)oxy]benzoïque [French] [ACD/IUPAC Name]
5-(3',3'-dimethylallyloxy)-2-methoxycarbonyl-3-methoxy-4-methylbenzoic acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 479.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.4±3.0 kJ/mol
Flash Point: 173.1±22.2 °C
Index of Refraction: 1.531
Molar Refractivity: 81.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.69
ACD/LogD (pH 5.5): 1.09
ACD/BCF (pH 5.5): 1.15
ACD/KOC (pH 5.5): 8.99
ACD/LogD (pH 7.4): 0.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.17
Polar Surface Area: 82 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 41.2±3.0 dyne/cm
Molar Volume: 263.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement