ChemSpider 2D Image | 2-Chloro-N,N'-bis[4-(N,N'-dimethylcarbamimidoyl)-3-methoxyphenyl]terephthalamide | C28H31ClN6O4

2-Chloro-N,N'-bis[4-(N,N'-dimethylcarbamimidoyl)-3-methoxyphenyl]terephthalamide

  • Molecular FormulaC28H31ClN6O4
  • Average mass551.036 Da
  • Monoisotopic mass550.209534 Da
  • ChemSpider ID367113

More details:

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

1,4-Benzenedicarboxamide, 2-chloro-N1,N4-bis[3-methoxy-4-[(Z)-(methylamino)(methylimino)methyl]phenyl]- [ACD/Index Name]
2-Chlor-N,N'-bis[4-(N,N'-dimethylcarbamimidoyl)-3-methoxyphenyl]terephthalamid [German] [ACD/IUPAC Name]
2-Chloro-N,N'-bis[4-(N,N'-diméthylcarbamimidoyl)-3-méthoxyphényl]téréphtalamide [French] [ACD/IUPAC Name]
2-Chloro-N,N'-bis[4-(N,N'-dimethylcarbamimidoyl)-3-methoxyphenyl]terephthalamide [ACD/IUPAC Name]
6128-52-5 [RN]

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

NSC61613 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 670.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.5±3.0 kJ/mol
Flash Point: 359.2±31.5 °C
Index of Refraction: 1.604
Molar Refractivity: 150.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 0.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.22
ACD/LogD (pH 7.4): 0.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.22
Polar Surface Area: 125 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 437.0±7.0 cm3

Click to predict properties on the Chemicalize site


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