ChemSpider 2D Image | Methyl (2R)-2-hydroxy-3-methyl-4-pentenoate | C7H12O3

Methyl (2R)-2-hydroxy-3-methyl-4-pentenoate

  • Molecular FormulaC7H12O3
  • Average mass144.168 Da
  • Monoisotopic mass144.078644 Da
  • ChemSpider ID61484985

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2R)-2-Hydroxy-3-méthyl-4-penténoate de méthyle [French] [ACD/IUPAC Name]
4-Pentenoic acid, 2-hydroxy-3-methyl-, methyl ester, (2R)- [ACD/Index Name]
Methyl (2R)-2-hydroxy-3-methyl-4-pentenoate [ACD/IUPAC Name]
Methyl-(2R)-2-hydroxy-3-methyl-4-pentenoat [German] [ACD/IUPAC Name]
1933717-55-5 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 184.2±20.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.8 mmHg at 25°C
Enthalpy of Vaporization: 48.9±6.0 kJ/mol
Flash Point: 65.6±14.5 °C
Index of Refraction: 1.444
Molar Refractivity: 37.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.57
ACD/LogD (pH 5.5): 0.84
ACD/BCF (pH 5.5): 2.56
ACD/KOC (pH 5.5): 68.27
ACD/LogD (pH 7.4): 0.84
ACD/BCF (pH 7.4): 2.56
ACD/KOC (pH 7.4): 68.27
Polar Surface Area: 47 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 32.3±3.0 dyne/cm
Molar Volume: 140.9±3.0 cm3

Click to predict properties on the Chemicalize site


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