ChemSpider 2D Image | (2S)-N,N-Dimethyl-1,2,3-propanetriamine | C5H15N3

(2S)-N,N-Dimethyl-1,2,3-propanetriamine

  • Molecular FormulaC5H15N3
  • Average mass117.193 Da
  • Monoisotopic mass117.126595 Da
  • ChemSpider ID32980818

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-N,N-Dimethyl-1,2,3-propanetriamine [ACD/IUPAC Name]
(2S)-N,N-Diméthyl-1,2,3-propanetriamine [French] [ACD/IUPAC Name]
(2S)-N,N-Dimethyl-1,2,3-propantriamin [German] [ACD/IUPAC Name]
1,2,3-Propanetriamine, N1,N1-dimethyl-, (2S)- [ACD/Index Name]
126268-91-5 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 213.6±8.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 45.0±3.0 kJ/mol
Flash Point: 82.3±13.2 °C
Index of Refraction: 1.482
Molar Refractivity: 36.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.88
ACD/LogD (pH 5.5): -5.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 55 Å2
Polarizability: 14.3±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 126.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement