ChemSpider 2D Image | (+)-2-ethylpentanoic acid | C7H14O2

(+)-2-ethylpentanoic acid

  • Molecular FormulaC7H14O2
  • Average mass130.185 Da
  • Monoisotopic mass130.099380 Da
  • ChemSpider ID32700156

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(+)-2-ethylpentanoic acid
(2S)-2-Ethylpentanoic acid [ACD/IUPAC Name]
(2S)-2-Ethylpentansäure [German] [ACD/IUPAC Name]
727722-15-8 [RN]
Acide (2S)-2-éthylpentanoïque [French] [ACD/IUPAC Name]
Pentanoic acid, 2-ethyl-, (2S)- [ACD/Index Name]
20225-24-5 [RN]
243-608-3 [EINECS]
2-Ethylpentanoic acid [ACD/IUPAC Name]
2-ETHYLPENTANOIC ACID, (+)-
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

L5P3139PDX [DBID]
UNII:L5P3139PDX [DBID]
UNII-L5P3139PDX [DBID]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 209.2±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.8 mmHg at 25°C
Enthalpy of Vaporization: 49.1±6.0 kJ/mol
Flash Point: 102.8±6.9 °C
Index of Refraction: 1.431
Molar Refractivity: 36.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.19
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 4.28
ACD/KOC (pH 5.5): 59.77
ACD/LogD (pH 7.4): -0.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 14.3±0.5 10-24cm3
Surface Tension: 31.6±3.0 dyne/cm
Molar Volume: 139.1±3.0 cm3

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