ChemSpider 2D Image | Dimethyl 4-acetylheptanedioate | C11H18O5

Dimethyl 4-acetylheptanedioate

  • Molecular FormulaC11H18O5
  • Average mass230.258 Da
  • Monoisotopic mass230.115417 Da
  • ChemSpider ID28822383

More details:

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

13984-54-8 [RN]
4-Acétylheptanedioate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 4-acetylheptanedioate [ACD/IUPAC Name]
Dimethyl-4-acetylheptandioat [German] [ACD/IUPAC Name]
Heptanedioic acid, 4-acetyl-, 1,7-dimethyl ester
Heptanedioic acid, 4-acetyl-, dimethyl ester [ACD/Index Name]
1,7-dimethyl 4-acetylheptanedioate
MFCD26593808

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

Density: 1.1±0.1 g/cm3
Boiling Point: 312.7±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 134.3±23.8 °C
Index of Refraction: 1.440
Molar Refractivity: 56.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 2.42
ACD/KOC (pH 5.5): 65.55
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 2.42
ACD/KOC (pH 7.4): 65.55
Polar Surface Area: 70 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 214.6±3.0 cm3

Click to predict properties on the Chemicalize site


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