ChemSpider 2D Image | 2-{4-[(2-Chloro-5-methylphenoxy)methyl]benzoyl}-N-cyclododecylhydrazinecarbothioamide | C28H38ClN3O2S

2-{4-[(2-Chloro-5-methylphenoxy)methyl]benzoyl}-N-cyclododecylhydrazinecarbothioamide

  • Molecular FormulaC28H38ClN3O2S
  • Average mass516.138 Da
  • Monoisotopic mass515.237305 Da
  • ChemSpider ID102317521

More details:

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

2-{4-[(2-Chlor-5-methylphenoxy)methyl]benzoyl}-N-cyclododecylhydrazincarbothioamid [German] [ACD/IUPAC Name]
2-{4-[(2-Chloro-5-methylphenoxy)methyl]benzoyl}-N-cyclododecylhydrazinecarbothioamide [ACD/IUPAC Name]
2-{4-[(2-Chloro-5-méthylphénoxy)méthyl]benzoyl}-N-cyclododécylhydrazinecarbothioamide [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(2-chloro-5-methylphenoxy)methyl]-, 2-[(cyclododecylamino)thioxomethyl]hydrazide [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.601
Molar Refractivity: 148.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 8.90
ACD/LogD (pH 5.5): 7.30
ACD/BCF (pH 5.5): 208167.89
ACD/KOC (pH 5.5): 223076.09
ACD/LogD (pH 7.4): 7.29
ACD/BCF (pH 7.4): 202693.33
ACD/KOC (pH 7.4): 217209.48
Polar Surface Area: 94 Å2
Polarizability: 58.8±0.5 10-24cm3
Surface Tension: 54.9±5.0 dyne/cm
Molar Volume: 432.7±5.0 cm3

Click to predict properties on the Chemicalize site


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