ChemSpider 2D Image | Methyl 4-[(5-chloro-2-pyrimidinyl)carbamoyl]benzoate | C13H10ClN3O3

Methyl 4-[(5-chloro-2-pyrimidinyl)carbamoyl]benzoate

  • Molecular FormulaC13H10ClN3O3
  • Average mass291.690 Da
  • Monoisotopic mass291.041077 Da
  • ChemSpider ID29436167

More details:

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

4-[(5-Chloro-2-pyrimidinyl)carbamoyl]benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[[(5-chloro-2-pyrimidinyl)amino]carbonyl]-, methyl ester [ACD/Index Name]
Methyl 4-[(5-chloro-2-pyrimidinyl)carbamoyl]benzoate [ACD/IUPAC Name]
Methyl-4-[(5-chlor-2-pyrimidinyl)carbamoyl]benzoat [German] [ACD/IUPAC Name]
methyl-4-(5-chloropyrimidin-2-ylcarbamoyl)benzoate

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.640
Molar Refractivity: 73.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.89
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 27.11
ACD/KOC (pH 5.5): 369.39
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 26.82
ACD/KOC (pH 7.4): 365.35
Polar Surface Area: 81 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 62.8±3.0 dyne/cm
Molar Volume: 204.6±3.0 cm3

Click to predict properties on the Chemicalize site


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