ChemSpider 2D Image | 3-Chloro-N-{2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}-N-methyl-1-adamantanecarboxamide | C21H26Cl2N2O3

3-Chloro-N-{2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}-N-methyl-1-adamantanecarboxamide

  • Molecular FormulaC21H26Cl2N2O3
  • Average mass425.349 Da
  • Monoisotopic mass424.132050 Da
  • ChemSpider ID21958105

More details:

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

3-Chlor-N-{2-[(5-chlor-2-methoxyphenyl)amino]-2-oxoethyl}-N-methyl-1-adamantancarboxamid [German] [ACD/IUPAC Name]
3-Chloro-N-{2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}-N-methyl-1-adamantanecarboxamide [ACD/IUPAC Name]
3-Chloro-N-{2-[(5-chloro-2-méthoxyphényl)amino]-2-oxoéthyl}-N-méthyl-1-adamantanecarboxamide [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-carboxamide, 3-chloro-N-[2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl]-N-methyl- [ACD/Index Name]
3-chloro-N-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethyl]-N-methyl-adamantane-1-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 593.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 312.5±30.1 °C
Index of Refraction: 1.606
Molar Refractivity: 109.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.62
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 756.97
ACD/KOC (pH 5.5): 4003.55
ACD/LogD (pH 7.4): 4.09
ACD/BCF (pH 7.4): 756.95
ACD/KOC (pH 7.4): 4003.43
Polar Surface Area: 59 Å2
Polarizability: 43.3±0.5 10-24cm3
Surface Tension: 55.4±5.0 dyne/cm
Molar Volume: 316.8±5.0 cm3

Click to predict properties on the Chemicalize site


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