ChemSpider 2D Image | 2-Chloro-6-methyl-N'-[4-methyl-3-(3-quinolinylethynyl)benzoyl]benzohydrazide | C27H20ClN3O2

2-Chloro-6-methyl-N'-[4-methyl-3-(3-quinolinylethynyl)benzoyl]benzohydrazide

  • Molecular FormulaC27H20ClN3O2
  • Average mass453.920 Da
  • Monoisotopic mass453.124420 Da
  • ChemSpider ID81367338

More details:






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

2-Chloro-6-méthyl-N'-[4-méthyl-3-(3-quinoléinyléthynyl)benzoyl]benzohydrazide [French] [ACD/IUPAC Name]
2-Chloro-6-methyl-N'-[4-methyl-3-(3-quinolinylethynyl)benzoyl]benzohydrazide [ACD/IUPAC Name]
Benzoic acid, 2-chloro-6-methyl-, 2-[4-methyl-3-[2-(3-quinolinyl)ethynyl]benzoyl]hydrazide [ACD/Index Name]
N'-[3-(3-Chinolinylethinyl)-4-methylbenzoyl]-2-chlor-6-methylbenzohydrazid [German] [ACD/IUPAC Name]
1388803-90-4 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 748.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.1±3.0 kJ/mol
Flash Point: 406.5±32.9 °C
Index of Refraction: 1.701
Molar Refractivity: 129.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.73
ACD/LogD (pH 5.5): 5.25
ACD/BCF (pH 5.5): 5788.47
ACD/KOC (pH 5.5): 17143.44
ACD/LogD (pH 7.4): 5.26
ACD/BCF (pH 7.4): 5800.89
ACD/KOC (pH 7.4): 17180.24
Polar Surface Area: 71 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 69.6±5.0 dyne/cm
Molar Volume: 335.1±5.0 cm3

Click to predict properties on the Chemicalize site






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