ChemSpider 2D Image | 4-Hydroxy-2-butanyl propionate | C7H14O3

4-Hydroxy-2-butanyl propionate

  • Molecular FormulaC7H14O3
  • Average mass146.184 Da
  • Monoisotopic mass146.094299 Da
  • ChemSpider ID32698191

More details:

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

1,3-Butanediol, 3-propanoate [ACD/Index Name]
1,3-BUTYLENE GLYCOL 3-PROPIONATE
4-Hydroxy-2-butanyl propionate [ACD/IUPAC Name]
4-Hydroxy-2-butanylpropionat [German] [ACD/IUPAC Name]
89457-40-9 [RN]
Propionate de 4-hydroxy-2-butanyle [French] [ACD/IUPAC Name]

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

72L1C5DO6J [DBID]
UNII:72L1C5DO6J [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 166.3±13.0 °C at 760 mmHg
Vapour Pressure: 0.6±0.7 mmHg at 25°C
Enthalpy of Vaporization: 46.9±6.0 kJ/mol
Flash Point: 52.8±12.6 °C
Index of Refraction: 1.432
Molar Refractivity: 37.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.64
ACD/LogD (pH 5.5): 0.66
ACD/BCF (pH 5.5): 1.87
ACD/KOC (pH 5.5): 54.47
ACD/LogD (pH 7.4): 0.66
ACD/BCF (pH 7.4): 1.87
ACD/KOC (pH 7.4): 54.47
Polar Surface Area: 47 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 33.3±3.0 dyne/cm
Molar Volume: 145.4±3.0 cm3

Click to predict properties on the Chemicalize site


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