Found 49 results

Search term: MF = 'C_{19}H_{17}Cl_{2}N_{5}'
ChemSpider 2D Image | 2-Chloro-4-{(2-chlorobenzyl)[1-(1-methyl-1H-1,2,3-triazol-4-yl)ethyl]amino}benzonitrile | C19H17Cl2N5

2-Chloro-4-{(2-chlorobenzyl)[1-(1-methyl-1H-1,2,3-triazol-4-yl)ethyl]amino}benzonitrile

  • Molecular FormulaC19H17Cl2N5
  • Average mass386.278 Da
  • Monoisotopic mass385.086090 Da
  • ChemSpider ID24620615

More details:

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

2-Chlor-4-{(2-chlorbenzyl)[1-(1-methyl-1H-1,2,3-triazol-4-yl)ethyl]amino}benzonitril [German] [ACD/IUPAC Name]
2-Chloro-4-{(2-chlorobenzyl)[1-(1-methyl-1H-1,2,3-triazol-4-yl)ethyl]amino}benzonitrile [ACD/IUPAC Name]
2-Chloro-4-{(2-chlorobenzyl)[1-(1-méthyl-1H-1,2,3-triazol-4-yl)éthyl]amino}benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-chloro-4-[[(2-chlorophenyl)methyl][1-(1-methyl-1H-1,2,3-triazol-4-yl)ethyl]amino]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 610.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.7±3.0 kJ/mol
Flash Point: 323.2±34.3 °C
Index of Refraction: 1.640
Molar Refractivity: 107.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.20
ACD/LogD (pH 5.5): 4.74
ACD/BCF (pH 5.5): 2379.46
ACD/KOC (pH 5.5): 9088.17
ACD/LogD (pH 7.4): 4.74
ACD/BCF (pH 7.4): 2379.52
ACD/KOC (pH 7.4): 9088.41
Polar Surface Area: 58 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 297.5±7.0 cm3

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