ChemSpider 2D Image | 2-[(4-Methyl-2-pentanyl)amino]-1,3-propanediol | C9H21NO2

2-[(4-Methyl-2-pentanyl)amino]-1,3-propanediol

  • Molecular FormulaC9H21NO2
  • Average mass175.268 Da
  • Monoisotopic mass175.157227 Da
  • ChemSpider ID32038830

More details:

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

1,3-Propanediol, 2-[(1,3-dimethylbutyl)amino]- [ACD/Index Name]
2-[(4-Methyl-2-pentanyl)amino]-1,3-propandiol [German] [ACD/IUPAC Name]
2-[(4-Methyl-2-pentanyl)amino]-1,3-propanediol [ACD/IUPAC Name]
2-[(4-Méthyl-2-pentanyl)amino]-1,3-propanediol [French] [ACD/IUPAC Name]
1492842-71-3 [RN]
2-[(4-methylpentan-2-yl)amino]propane-1,3-diol
MFCD21187323

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

Density: 1.0±0.1 g/cm3
Boiling Point: 295.1±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 62.0±6.0 kJ/mol
Flash Point: 103.0±12.4 °C
Index of Refraction: 1.465
Molar Refractivity: 50.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): -1.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.25
Polar Surface Area: 52 Å2
Polarizability: 19.9±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 182.1±3.0 cm3

Click to predict properties on the Chemicalize site


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