ChemSpider 2D Image | (2S)-2-Hydroxypentanenitrile | C5H9NO

(2S)-2-Hydroxypentanenitrile

  • Molecular FormulaC5H9NO
  • Average mass99.131 Da
  • Monoisotopic mass99.068413 Da
  • ChemSpider ID61031481

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Hydroxypentanenitrile [ACD/IUPAC Name]
(2S)-2-Hydroxypentanenitrile [French] [ACD/IUPAC Name]
(2S)-2-Hydroxypentannitril [German] [ACD/IUPAC Name]
107537-99-5 [RN]
Pentanenitrile, 2-hydroxy-, (2S)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 207.3±13.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.9 mmHg at 25°C
Enthalpy of Vaporization: 51.6±6.0 kJ/mol
Flash Point: 79.2±19.8 °C
Index of Refraction: 1.433
Molar Refractivity: 26.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.17
ACD/LogD (pH 5.5): 0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 29.95
ACD/LogD (pH 7.4): 0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.94
Polar Surface Area: 44 Å2
Polarizability: 10.6±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 102.3±3.0 cm3

Click to predict properties on the Chemicalize site


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