ChemSpider 2D Image | Ethyl 2-ethylacetoacetate | C8H14O3

Ethyl 2-ethylacetoacetate

  • Molecular FormulaC8H14O3
  • Average mass158.195 Da
  • Monoisotopic mass158.094299 Da
  • ChemSpider ID21171499

More details:






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

210-151-6 [EINECS]
2-Éthyl-3-oxobutanoate d'éthyle [French] [ACD/IUPAC Name]
607-97-6 [RN]
Butanoic acid, 2-ethyl-3-oxo-, ethyl ester [ACD/Index Name]
Ethyl 2-ethyl-3-oxobutanoate [ACD/IUPAC Name]
Ethyl 2-ethylacetoacetate
Ethyl-2-ethyl-3-oxobutanoat [German] [ACD/IUPAC Name]
(2R)-2-ethyl-3-oxobutanoic acid ethyl ester
[607-97-6]
141327-44-8 [RN]
More...

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

MFCD00039898 [DBID]
02840_FLUKA [DBID]
165263_ALDRICH [DBID]
CCRIS 4693 [DBID]
NSC 53775 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 190.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.6±0.3 mmHg at 25°C
Enthalpy of Vaporization: 42.6±3.0 kJ/mol
Flash Point: 75.7±18.5 °C
Index of Refraction: 1.420
Molar Refractivity: 40.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.60
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 4.29
ACD/KOC (pH 5.5): 98.71
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.29
ACD/KOC (pH 7.4): 98.70
Polar Surface Area: 43 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 29.8±3.0 dyne/cm
Molar Volume: 161.6±3.0 cm3

Click to predict properties on the Chemicalize site






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