ChemSpider 2D Image | (3R,3'R)-N~1~,N~1~'-1,4-Butanediyldi(1,3-butanediamine) | C12H30N4

(3R,3'R)-N1,N1'-1,4-Butanediyldi(1,3-butanediamine)

  • Molecular FormulaC12H30N4
  • Average mass230.393 Da
  • Monoisotopic mass230.247040 Da
  • ChemSpider ID25058719

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,3'R)-N1,N1'-1,4-Butandiyldi(1,3-butandiamin) [German] [ACD/IUPAC Name]
(3R,3'R)-N1,N1'-1,4-Butanediyldi(1,3-butanediamine) [ACD/IUPAC Name]
(3R,3'R)-N1,N1'-1,4-Butanediyldi(1,3-butanediamine) [French] [ACD/IUPAC Name]
(3R,3'R)-N1,N1'-butane-1,4-diyldibutane-1,3-diamine
1,3-Butanediamine, N1,N1'-1,4-butanediylbis-, (3R,3'R)- [ACD/Index Name]
SPJ

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

Density: 0.9±0.1 g/cm3
Boiling Point: 329.7±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.2±3.0 kJ/mol
Flash Point: 179.4±22.6 °C
Index of Refraction: 1.481
Molar Refractivity: 71.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 6
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: -0.27
ACD/LogD (pH 5.5): -6.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 28.5±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 252.4±3.0 cm3

Click to predict properties on the Chemicalize site


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