ChemSpider 2D Image | (3S)-3-Ethoxy-2-oxobutanal | C6H10O3

(3S)-3-Ethoxy-2-oxobutanal

  • Molecular FormulaC6H10O3
  • Average mass130.142 Da
  • Monoisotopic mass130.062988 Da
  • ChemSpider ID34995975

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Ethoxy-2-oxobutanal [German] [ACD/IUPAC Name]
(3S)-3-Ethoxy-2-oxobutanal [ACD/IUPAC Name]
(3S)-3-Éthoxy-2-oxobutanal [French] [ACD/IUPAC Name]
Butanal, 3-ethoxy-2-oxo-, (3S)- [ACD/Index Name]
222-986-3 [EINECS]
3688-37-7 [RN]
KETHOXAL ANHYDROUS
UNII-2HAV7G194P

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

Density: 1.0±0.1 g/cm3
Boiling Point: 151.2±23.0 °C at 760 mmHg
Vapour Pressure: 3.7±0.3 mmHg at 25°C
Enthalpy of Vaporization: 38.8±3.0 kJ/mol
Flash Point: 49.1±22.7 °C
Index of Refraction: 1.408
Molar Refractivity: 31.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.08
ACD/LogD (pH 5.5): -0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.04
ACD/LogD (pH 7.4): -0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.04
Polar Surface Area: 43 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 30.2±3.0 dyne/cm
Molar Volume: 128.8±3.0 cm3

Click to predict properties on the Chemicalize site


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