ChemSpider 2D Image | Dimethyl 5-[(N-methyl-N-{[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl}glycyl)amino]isophthalate | C17H17F3N4O6

Dimethyl 5-[(N-methyl-N-{[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl}glycyl)amino]isophthalate

  • Molecular FormulaC17H17F3N4O6
  • Average mass430.335 Da
  • Monoisotopic mass430.110016 Da
  • ChemSpider ID30398007

More details:

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

1,3-Benzenedicarboxylic acid, 5-[[2-[methyl[[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl]amino]acetyl]amino]-, dimethyl ester [ACD/Index Name]
5-[(N-Méthyl-N-{[3-(trifluorométhyl)-1,2,4-oxadiazol-5-yl]méthyl}glycyl)amino]isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-[(N-methyl-N-{[3-(trifluoromethyl)-1,2,4-oxadiazol-5-yl]methyl}glycyl)amino]isophthalate [ACD/IUPAC Name]
Dimethyl-5-[(N-methyl-N-{[3-(trifluormethyl)-1,2,4-oxadiazol-5-yl]methyl}glycyl)amino]isophthalat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.542
Molar Refractivity: 95.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 2.65
ACD/LogD (pH 5.5): 1.78
ACD/BCF (pH 5.5): 13.18
ACD/KOC (pH 5.5): 220.01
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 13.25
ACD/KOC (pH 7.4): 221.26
Polar Surface Area: 124 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 302.0±3.0 cm3

Click to predict properties on the Chemicalize site


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