ChemSpider 2D Image | MFCD19687021 | C7H12D6N2

MFCD19687021

  • Molecular FormulaC7H12D6N2
  • Average mass136.268 Da
  • Monoisotopic mass136.184662 Da
  • ChemSpider ID49072376

  • Non-standard isotope - Non-standard isotope

More details:

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

1,3-Propane-1,1-d2-diamine, N1,N3-di(ethyl-1,1-d2)- [ACD/Index Name]
MFCD19687021
N,N'-Bis[(1,1-2H2)ethyl]-1,3-(1,1-2H2)propandiamin [German] [ACD/IUPAC Name]
N,N'-Bis[(1,1-2H2)ethyl]-1,3-(1,1-2H2)propanediamine [ACD/IUPAC Name]
N,N'-Bis[(1,1-2H2)éthyl]-1,3-(1,1-2H2)propanediamine [French] [ACD/IUPAC Name]
N,N-Diethyl-1,1,1',1'-d4,-1,3-propanediamine-1,1-d2

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

Density: 0.8±0.1 g/cm3
Boiling Point: 185.9±8.0 °C at 760 mmHg
Vapour Pressure: 0.7±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.2±3.0 kJ/mol
Flash Point: 50.6±0.0 °C
Index of Refraction: 1.429
Molar Refractivity: 41.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.51
ACD/LogD (pH 5.5): -3.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 24 Å2
Polarizability: 16.5±0.5 10-24cm3
Surface Tension: 26.4±3.0 dyne/cm
Molar Volume: 161.7±3.0 cm3

Click to predict properties on the Chemicalize site


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