ChemSpider 2D Image | N~3~-(4-Aminobutyl)-1,3-butanediamine | C8H21N3

N3-(4-Aminobutyl)-1,3-butanediamine

  • Molecular FormulaC8H21N3
  • Average mass159.272 Da
  • Monoisotopic mass159.173553 Da
  • ChemSpider ID28653496

More details:

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

1,3-Butanediamine, N3-(4-aminobutyl)- [ACD/Index Name]
N3-(4-Aminobutyl)-1,3-butandiamin [German] [ACD/IUPAC Name]
N3-(4-Aminobutyl)-1,3-butanediamine [ACD/IUPAC Name]
N3-(4-Aminobutyl)-1,3-butanediamine [French] [ACD/IUPAC Name]
1,8-diamino-3-methyl-4-azaoctane

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

Density: 0.9±0.1 g/cm3
Boiling Point: 247.2±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.4±3.0 kJ/mol
Flash Point: 118.5±22.0 °C
Index of Refraction: 1.473
Molar Refractivity: 49.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -0.49
ACD/LogD (pH 5.5): -5.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 64 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 177.1±3.0 cm3

Click to predict properties on the Chemicalize site


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