ChemSpider 2D Image | (2S,3R)-2-Ethyl-3-methylpentanamide | C8H17NO

(2S,3R)-2-Ethyl-3-methylpentanamide

  • Molecular FormulaC8H17NO
  • Average mass143.227 Da
  • Monoisotopic mass143.131012 Da
  • ChemSpider ID34984053

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3R)-2-Ethyl-3-methylpentanamid [German] [ACD/IUPAC Name]
(2S,3R)-2-Ethyl-3-methylpentanamide [ACD/IUPAC Name]
(2S,3R)-2-Éthyl-3-méthylpentanamide [French] [ACD/IUPAC Name]
Pentanamide, 2-ethyl-3-methyl-, (2S,3R)- [ACD/Index Name]
224-033-7 [EINECS]
4171-13-5 [RN]
UNII-3O25NRX9YG
Valnoctamide [INN] [USAN] [Wiki]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 274.4±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.3±3.0 kJ/mol
Flash Point: 119.8±18.4 °C
Index of Refraction: 1.438
Molar Refractivity: 42.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.70
ACD/KOC (pH 5.5): 238.35
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 14.70
ACD/KOC (pH 7.4): 238.35
Polar Surface Area: 43 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 29.9±3.0 dyne/cm
Molar Volume: 162.1±3.0 cm3

Click to predict properties on the Chemicalize site


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