ChemSpider 2D Image | Methyl 3-acetoxy-2-methylbutyrate | C8H14O4

Methyl 3-acetoxy-2-methylbutyrate

  • Molecular FormulaC8H14O4
  • Average mass174.194 Da
  • Monoisotopic mass174.089203 Da
  • ChemSpider ID26535257

More details:

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

139564-42-4 [RN]
1VOY1&Y1&VO1 [WLN]
3-Acétoxy-2-méthylbutanoate de méthyle [French] [ACD/IUPAC Name]
7579341 [Beilstein]
Butanoic acid, 3-(acetyloxy)-2-methyl-, methyl ester [ACD/Index Name]
Methyl 3-(acetoxy)-2-methylbutanoate
Methyl 3-acetoxy-2-methylbutyrate [ACD/IUPAC Name]
Methyl-3-acetoxy-2-methylbutanoat [German] [ACD/IUPAC Name]

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

533CJX72JV [DBID]
L157540018 [DBID]
P49N6K5WAQ [DBID]
YG2N91SLXN [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 150.3±13.0 °C at 760 mmHg
Vapour Pressure: 3.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 38.7±3.0 kJ/mol
Flash Point: 57.0±18.2 °C
Index of Refraction: 1.420
Molar Refractivity: 42.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.14
ACD/LogD (pH 5.5): 1.41
ACD/BCF (pH 5.5): 6.95
ACD/KOC (pH 5.5): 139.40
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 6.95
ACD/KOC (pH 7.4): 139.40
Polar Surface Area: 53 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 30.2±3.0 dyne/cm
Molar Volume: 168.3±3.0 cm3

Click to predict properties on the Chemicalize site


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