ChemSpider 2D Image | N-[3-Amino(~2~H_6_)propyl]-1,4-butanediamine | C7H13D6N3

N-[3-Amino(2H6)propyl]-1,4-butanediamine

  • Molecular FormulaC7H13D6N3
  • Average mass151.283 Da
  • Monoisotopic mass151.195557 Da
  • ChemSpider ID58794682
  • Non-standard isotope - Non-standard isotope


More details:






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

1,4-Butanediamine, N1-(3-aminopropyl-1,1,2,2,3,3-d6)- [ACD/Index Name]
N-[3-Amino(2H6)propyl]-1,4-butandiamin [German] [ACD/IUPAC Name]
N-[3-Amino(2H6)propyl]-1,4-butanediamine [ACD/IUPAC Name]
N-[3-Amino(2H6)propyl]-1,4-butanediamine [French] [ACD/IUPAC Name]
N-(3-Aminopropyl-d6)-1,4-butanediamine (>C.P. >96%)
spermidine [Wiki]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 246.6±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: 118.1±22.0 °C
Index of Refraction: 1.475
Molar Refractivity: 45.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -0.84
ACD/LogD (pH 5.5): -6.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 64 Å2
Polarizability: 17.9±0.5 10-24cm3
Surface Tension: 37.5±3.0 dyne/cm
Molar Volume: 160.3±3.0 cm3

Click to predict properties on the Chemicalize site






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