ChemSpider 2D Image | N'-[(E)-{3-[(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylene]-2-chlorobenzohydrazide | C21H20BrClN4O2

N'-[(E)-{3-[(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylene]-2-chlorobenzohydrazide

  • Molecular FormulaC21H20BrClN4O2
  • Average mass475.766 Da
  • Monoisotopic mass474.045807 Da
  • ChemSpider ID22931183

  • Double-bond stereo - Double-bond stereo

More details:

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

Benzoic acid, 2-chloro-, 2-[(1E)-[3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl]methylene]hydrazide [ACD/Index Name]
N'-[(E)-{3-[(4-Brom-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylen]-2-chlorbenzohydrazid [German] [ACD/IUPAC Name]
N'-[(E)-{3-[(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methylene]-2-chlorobenzohydrazide [ACD/IUPAC Name]
N'-[(E)-{3-[(4-Bromo-3,5-diméthyl-1H-pyrazol-1-yl)méthyl]-4-méthoxyphényl}méthylène]-2-chlorobenzohydrazide [French] [ACD/IUPAC Name]
N-[[3-[(4-BROMO-3,5-DIMETHYLPYRAZOL-1-YL)METHYL]-4-METHOXYPHENYL]METHYLIDENEAMINO]-2-CHLOROBENZAMIDE

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: 1.631
Molar Refractivity: 118.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.21
ACD/LogD (pH 5.5): 4.32
ACD/BCF (pH 5.5): 1138.30
ACD/KOC (pH 5.5): 5361.24
ACD/LogD (pH 7.4): 4.32
ACD/BCF (pH 7.4): 1138.20
ACD/KOC (pH 7.4): 5360.74
Polar Surface Area: 69 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 46.4±7.0 dyne/cm
Molar Volume: 332.9±7.0 cm3

Click to predict properties on the Chemicalize site


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