ChemSpider 2D Image | Methyl N-{[5-(4-chlorophenyl)-2H-tetrazol-2-yl]acetyl}-3-methyl-L-valinate | C16H20ClN5O3

Methyl N-{[5-(4-chlorophenyl)-2H-tetrazol-2-yl]acetyl}-3-methyl-L-valinate

  • Molecular FormulaC16H20ClN5O3
  • Average mass365.815 Da
  • Monoisotopic mass365.125458 Da
  • ChemSpider ID30273093

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Valine, N-[2-[5-(4-chlorophenyl)-2H-tetrazol-2-yl]acetyl]-3-methyl-, methyl ester [ACD/Index Name]
Methyl N-{[5-(4-chlorophenyl)-2H-tetrazol-2-yl]acetyl}-3-methyl-L-valinate [ACD/IUPAC Name]
Methyl-N-{[5-(4-chlorphenyl)-2H-tetrazol-2-yl]acetyl}-3-methyl-L-valinat [German] [ACD/IUPAC Name]
N-{2-[5-(4-Chlorophényl)-2H-tétrazol-2-yl]acétyl}-3-méthyl-L-valinate de méthyle [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.606
Molar Refractivity: 94.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 32.05
ACD/KOC (pH 5.5): 416.41
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 32.05
ACD/KOC (pH 7.4): 416.40
Polar Surface Area: 99 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 46.9±7.0 dyne/cm
Molar Volume: 275.0±7.0 cm3

Click to predict properties on the Chemicalize site


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