ChemSpider 2D Image | N-Methyl-N-{[3-(methylsulfanyl)-2-pyrazinyl]methyl}-1,2-ethanediamine | C9H16N4S

N-Methyl-N-{[3-(methylsulfanyl)-2-pyrazinyl]methyl}-1,2-ethanediamine

  • Molecular FormulaC9H16N4S
  • Average mass212.315 Da
  • Monoisotopic mass212.109573 Da
  • ChemSpider ID28302323

More details:






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

1,2-Ethanediamine, N1-methyl-N1-[[3-(methylthio)-2-pyrazinyl]methyl]- [ACD/Index Name]
N-Methyl-N-{[3-(methylsulfanyl)-2-pyrazinyl]methyl}-1,2-ethandiamin [German] [ACD/IUPAC Name]
N-Methyl-N-{[3-(methylsulfanyl)-2-pyrazinyl]methyl}-1,2-ethanediamine [ACD/IUPAC Name]
N-Méthyl-N-{[3-(méthylsulfanyl)-2-pyrazinyl]méthyl}-1,2-éthanediamine [French] [ACD/IUPAC Name]
(2-AMINOETHYL)(METHYL){[3-(METHYLSULFANYL)PYRAZIN-2-YL]METHYL}AMINE
1353962-61-4 [RN]
MFCD21097472
N*1*-methyl-N*1*-(3-methylsulfanylpyrazin-2-ylmethyl)ethane-1,2-diamine
N*1*-Methyl-N*1*-(3-methylsulfanyl-pyrazin-2-ylmethyl)-ethane-1,2-diamine
N1-Methyl-N1-((3-(methylthio)pyrazin-2-yl)methyl)ethane-1,2-diamine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 308.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.9±3.0 kJ/mol
Flash Point: 140.5±27.9 °C
Index of Refraction: 1.585
Molar Refractivity: 61.0±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.14
ACD/LogD (pH 5.5): -2.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 80 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 57.7±5.0 dyne/cm
Molar Volume: 182.0±5.0 cm3

Click to predict properties on the Chemicalize site






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