ChemSpider 2D Image | Butyl (2R)-2-hydroxybutanoate | C8H16O3

Butyl (2R)-2-hydroxybutanoate

  • Molecular FormulaC8H16O3
  • Average mass160.211 Da
  • Monoisotopic mass160.109940 Da
  • ChemSpider ID27472637

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-Hydroxybutanoate de butyle [French] [ACD/IUPAC Name]
Butanoic acid, 2-hydroxy-, butyl ester, (2R)- [ACD/Index Name]
Butyl (2R)-2-hydroxybutanoate [ACD/IUPAC Name]
Butyl-(2R)-2-hydroxybutanoat [German] [ACD/IUPAC Name]
(S)-2-HYDROXYBUTANOIC ACID N-BUTYL ESTER
132513-51-0 [RN]
928835-95-4 [RN]
Butanoic acid,2-hydroxy-,butyl ester,(2R)-
n-butyl (s)-2-hydroxybutyrate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 204.6±8.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.9 mmHg at 25°C
Enthalpy of Vaporization: 51.3±6.0 kJ/mol
Flash Point: 79.2±6.4 °C
Index of Refraction: 1.436
Molar Refractivity: 42.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 8.18
ACD/KOC (pH 5.5): 156.64
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 8.18
ACD/KOC (pH 7.4): 156.64
Polar Surface Area: 47 Å2
Polarizability: 16.8±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 162.0±3.0 cm3

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