ChemSpider 2D Image | N-[(3-Chloro-4-pyridinyl)methyl]-N-ethyl-1-(ethylsulfonyl)-2-propanamine | C13H21ClN2O2S

N-[(3-Chloro-4-pyridinyl)methyl]-N-ethyl-1-(ethylsulfonyl)-2-propanamine

  • Molecular FormulaC13H21ClN2O2S
  • Average mass304.836 Da
  • Monoisotopic mass304.101227 Da
  • ChemSpider ID30458167

More details:

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

4-Pyridinemethanamine, 3-chloro-N-ethyl-N-[2-(ethylsulfonyl)-1-methylethyl]- [ACD/Index Name]
N-[(3-Chlor-4-pyridinyl)methyl]-N-ethyl-1-(ethylsulfonyl)-2-propanamin [German] [ACD/IUPAC Name]
N-[(3-Chloro-4-pyridinyl)methyl]-N-ethyl-1-(ethylsulfonyl)-2-propanamine [ACD/IUPAC Name]
N-[(3-Chloro-4-pyridinyl)méthyl]-N-éthyl-1-(éthylsulfonyl)-2-propanamine [French] [ACD/IUPAC Name]
[(3-CHLOROPYRIDIN-4-YL)METHYL][1-(ETHANESULFONYL)PROPAN-2-YL]ETHYLAMINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 443.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.1±3.0 kJ/mol
Flash Point: 222.1±27.3 °C
Index of Refraction: 1.532
Molar Refractivity: 79.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): 1.80
ACD/BCF (pH 5.5): 12.33
ACD/KOC (pH 5.5): 183.26
ACD/LogD (pH 7.4): 2.01
ACD/BCF (pH 7.4): 19.80
ACD/KOC (pH 7.4): 294.26
Polar Surface Area: 59 Å2
Polarizability: 31.4±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 255.1±3.0 cm3

Click to predict properties on the Chemicalize site


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