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Search term: SXMQMOJIKMECGG-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 1-(3-Chlorophenyl)-3-(4-methyl-3-pyridinyl)urea | C13H12ClN3O

1-(3-Chlorophenyl)-3-(4-methyl-3-pyridinyl)urea

  • Molecular FormulaC13H12ClN3O
  • Average mass261.707 Da
  • Monoisotopic mass261.066895 Da
  • ChemSpider ID75962964

More details:

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

1-(3-Chlorophenyl)-3-(4-methyl-3-pyridinyl)urea [ACD/IUPAC Name]
1-(3-Chlorophényl)-3-(4-méthyl-3-pyridinyl)urée [French] [ACD/IUPAC Name]
1-(3-Chlorphenyl)-3-(4-methyl-3-pyridinyl)harnstoff [German] [ACD/IUPAC Name]
Urea, N-(3-chlorophenyl)-N'-(4-methyl-3-pyridinyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 322.4±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.4±3.0 kJ/mol
Flash Point: 148.8±26.5 °C
Index of Refraction: 1.687
Molar Refractivity: 72.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 40.83
ACD/KOC (pH 5.5): 341.05
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 146.56
ACD/KOC (pH 7.4): 1224.19
Polar Surface Area: 54 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 60.3±3.0 dyne/cm
Molar Volume: 191.3±3.0 cm3

Click to predict properties on the Chemicalize site


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