ChemSpider 2D Image | 2,6-Dichloro-4-[(5-{[isopropyl(methyl)amino]methyl}-1,2,4-oxadiazol-3-yl)methyl]aniline | C14H18Cl2N4O

2,6-Dichloro-4-[(5-{[isopropyl(methyl)amino]methyl}-1,2,4-oxadiazol-3-yl)methyl]aniline

  • Molecular FormulaC14H18Cl2N4O
  • Average mass329.225 Da
  • Monoisotopic mass328.085754 Da
  • ChemSpider ID65036603

More details:

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

1,2,4-Oxadiazole-5-methanamine, 3-[(4-amino-3,5-dichlorophenyl)methyl]-N-methyl-N-(1-methylethyl)- [ACD/Index Name]
2,6-Dichlor-4-[(5-{[isopropyl(methyl)amino]methyl}-1,2,4-oxadiazol-3-yl)methyl]anilin [German] [ACD/IUPAC Name]
2,6-Dichloro-4-[(5-{[isopropyl(methyl)amino]methyl}-1,2,4-oxadiazol-3-yl)methyl]aniline [ACD/IUPAC Name]
2,6-Dichloro-4-[(5-{[isopropyl(méthyl)amino]méthyl}-1,2,4-oxadiazol-3-yl)méthyl]aniline [French] [ACD/IUPAC 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: 444.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 222.4±31.5 °C
Index of Refraction: 1.585
Molar Refractivity: 85.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 11.08
ACD/KOC (pH 5.5): 96.14
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 116.47
ACD/KOC (pH 7.4): 1010.43
Polar Surface Area: 68 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 254.2±3.0 cm3

Click to predict properties on the Chemicalize site


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