ChemSpider 2D Image | 3-(5-CHLOROMETHYL-[1,2,4]OXADIAZOL-3-YL)-ANILINE | C9H8ClN3O

3-(5-CHLOROMETHYL-[1,2,4]OXADIAZOL-3-YL)-ANILINE

  • Molecular FormulaC9H8ClN3O
  • Average mass209.632 Da
  • Monoisotopic mass209.035583 Da
  • ChemSpider ID21373803

More details:






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

3-(5-CHLOROMETHYL-[1,2,4]OXADIAZOL-3-YL)-ANILINE
3-[5-(Chlormethyl)-1,2,4-oxadiazol-3-yl]anilin [German] [ACD/IUPAC Name]
3-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]aniline [ACD/IUPAC Name]
3-[5-(Chlorométhyl)-1,2,4-oxadiazol-3-yl]aniline [French] [ACD/IUPAC Name]
6595-79-5 [RN]
Benzenamine, 3-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]- [ACD/Index Name]
[6595-79-5]
3-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)aniline
3-(5-Chloromethyl-[1,2,4]oxadiazol-3-yl)aniline
3-(5-Chloromethyl-[1,2,4]oxadiazol-3-yl)-phenylamine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 406.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.9±3.0 kJ/mol
Flash Point: 199.8±31.5 °C
Index of Refraction: 1.609
Molar Refractivity: 53.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 7.25
ACD/KOC (pH 5.5): 143.59
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 7.27
ACD/KOC (pH 7.4): 144.04
Polar Surface Area: 65 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 57.6±3.0 dyne/cm
Molar Volume: 153.9±3.0 cm3

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