ChemSpider 2D Image | MFCD01841973 | C17H13BrN4O2

MFCD01841973

  • Molecular FormulaC17H13BrN4O2
  • Average mass385.215 Da
  • Monoisotopic mass384.022186 Da
  • ChemSpider ID21492454

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Pyrazole-5-carboxylic acid, 3-(4-bromophenyl)-, 2-[(1E)-(2-hydroxyphenyl)methylene]hydrazide [ACD/Index Name]
3-(4-Bromophenyl)-N'-[(E)-(2-hydroxyphenyl)methylene]-1H-pyrazole-5-carbohydrazide [ACD/IUPAC Name]
3-(4-Bromophényl)-N'-[(E)-(2-hydroxyphényl)méthylène]-1H-pyrazole-5-carbohydrazide [French] [ACD/IUPAC Name]
3-(4-Bromphenyl)-N'-[(E)-(2-hydroxyphenyl)methylen]-1H-pyrazol-5-carbohydrazid [German] [ACD/IUPAC Name]
MFCD01841973
3-(4-BROMOPHENYL)-N`-[(1E)-(2-HYDROXYPHENYL)METHYLIDENE]-1H-PYRAZOLE-5-CARBOHYDRAZIDE
5-(4-BROMOPHENYL)-N`-[(1E)-(2-HYDROXYPHENYL)METHYLIDENE]-2H-PYRAZOLE-3-CARBOHYDRAZIDE
5-(4-BR-PHENYL)-2H-PYRAZOLE-3-CARBOXYLIC ACID (2-HYDROXY-BENZYLIDENE)-HYDRAZIDE

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.694
Molar Refractivity: 94.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 3.92
ACD/BCF (pH 5.5): 559.95
ACD/KOC (pH 5.5): 3220.59
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 372.64
ACD/KOC (pH 7.4): 2143.24
Polar Surface Area: 90 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 57.8±7.0 dyne/cm
Molar Volume: 246.7±7.0 cm3

Click to predict properties on the Chemicalize site


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