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ChemSpider 2D Image | N-(3,4-Dichlorophenyl)-4-pyrimidinecarboxamide | C11H7Cl2N3O

N-(3,4-Dichlorophenyl)-4-pyrimidinecarboxamide

  • Molecular FormulaC11H7Cl2N3O
  • Average mass268.099 Da
  • Monoisotopic mass266.996613 Da
  • ChemSpider ID24624692

More details:






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

4-Pyrimidinecarboxamide, N-(3,4-dichlorophenyl)- [ACD/Index Name]
N-(3,4-Dichlorophenyl)-4-pyrimidinecarboxamide [ACD/IUPAC Name]
N-(3,4-Dichlorophényl)-4-pyrimidinecarboxamide [French] [ACD/IUPAC Name]
N-(3,4-Dichlorphenyl)-4-pyrimidincarboxamid [German] [ACD/IUPAC Name]
1161205-01-1 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 330.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.3±3.0 kJ/mol
Flash Point: 153.7±26.5 °C
Index of Refraction: 1.671
Molar Refractivity: 66.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 2.58
ACD/BCF (pH 5.5): 53.30
ACD/KOC (pH 5.5): 599.21
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 53.11
ACD/KOC (pH 7.4): 597.14
Polar Surface Area: 55 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 64.8±3.0 dyne/cm
Molar Volume: 178.7±3.0 cm3

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