ChemSpider 2D Image | (3R)-3-Hydroxy-5,5-dimethylhexanoic acid | C8H16O3

(3R)-3-Hydroxy-5,5-dimethylhexanoic acid

  • Molecular FormulaC8H16O3
  • Average mass160.211 Da
  • Monoisotopic mass160.109940 Da
  • ChemSpider ID25036093

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Hydroxy-5,5-dimethylhexanoic acid [ACD/IUPAC Name]
(3R)-3-Hydroxy-5,5-dimethylhexansäure [German] [ACD/IUPAC Name]
Acide (3R)-3-hydroxy-5,5-diméthylhexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 3-hydroxy-5,5-dimethyl-, (3R)- [ACD/Index Name]
149715-68-4 [RN]
GVM

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

Density: 1.0±0.1 g/cm3
Boiling Point: 273.3±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 59.4±6.0 kJ/mol
Flash Point: 133.3±19.1 °C
Index of Refraction: 1.462
Molar Refractivity: 42.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.62
ACD/LogD (pH 5.5): -0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.48
ACD/LogD (pH 7.4): -2.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 153.1±3.0 cm3

Click to predict properties on the Chemicalize site


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