Found 3 results

Search term: SDGAEBKMHIPSAC (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Ethyl 4-oxo-2-butenoate | C6H8O3

Ethyl 4-oxo-2-butenoate

  • Molecular FormulaC6H8O3
  • Average mass128.126 Da
  • Monoisotopic mass128.047348 Da
  • ChemSpider ID26536798

More details:

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

2-Butenoic acid, 4-oxo-, ethyl ester [ACD/Index Name]
4-Oxo-2-buténoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-oxo-2-butenoate [ACD/IUPAC Name]
Ethyl-4-oxo-2-butenoat [German] [ACD/IUPAC Name]
(E)-4-oxobut-2-enoic acid ethyl ester
(E)-Ethyl 4-oxobut-2-enoate
2960-66-9 [RN]
Ethyl (2E)-4-oxobut-2-enoate
ETHYL TRANS-4-OXO-2-BUTENOATE
MFCD00236170 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 199.3±23.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.6±3.0 kJ/mol
Flash Point: 78.6±22.7 °C
Index of Refraction: 1.436
Molar Refractivity: 31.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.00
ACD/LogD (pH 5.5): 0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 31.30
ACD/LogD (pH 7.4): 0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.30
Polar Surface Area: 43 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 32.7±3.0 dyne/cm
Molar Volume: 122.0±3.0 cm3

Click to predict properties on the Chemicalize site


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