ChemSpider 2D Image | (2R)-2-Hydroxypropyl heptanoate | C10H20O3

(2R)-2-Hydroxypropyl heptanoate

  • Molecular FormulaC10H20O3
  • Average mass188.264 Da
  • Monoisotopic mass188.141251 Da
  • ChemSpider ID34995599

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-Hydroxypropyl heptanoate [ACD/IUPAC Name]
(2R)-2-Hydroxypropyl-heptanoat [German] [ACD/IUPAC Name]
Heptanoate de (2R)-2-hydroxypropyle [French] [ACD/IUPAC Name]
Heptanoic acid, (2R)-2-hydroxypropyl ester [ACD/Index Name]
230-658-6 [EINECS]
7249-54-9 [RN]
PROPYLENE GLYCOL HEPTANOATE
UNII-25DEK56Z7Z

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

Density: 1.0±0.1 g/cm3
Boiling Point: 281.9±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 60.4±6.0 kJ/mol
Flash Point: 111.2±12.6 °C
Index of Refraction: 1.443
Molar Refractivity: 51.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.35
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 41.37
ACD/KOC (pH 5.5): 499.81
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 41.37
ACD/KOC (pH 7.4): 499.81
Polar Surface Area: 47 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 195.0±3.0 cm3

Click to predict properties on the Chemicalize site


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