ChemSpider 2D Image | triarimol | C17H12Cl2N2O

triarimol

  • Molecular FormulaC17H12Cl2N2O
  • Average mass331.196 Da
  • Monoisotopic mass330.032654 Da
  • ChemSpider ID34988843

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(R)-(2,4-Dichlorophenyl)(phenyl)5-pyrimidinylmethanol [ACD/IUPAC Name]
(R)-(2,4-Dichlorophényl)(phényl)5-pyrimidinylméthanol [French] [ACD/IUPAC Name]
(R)-(2,4-Dichlorphenyl)(phenyl)5-pyrimidinylmethanol [German] [ACD/IUPAC Name]
(R)-triarimol
5-Pyrimidinemethanol, α-(2,4-dichlorophenyl)-α-phenyl-, (αR)- [ACD/Index Name]
triarimol [BSI] [ISO]
(R)-(2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol
26766-27-8 [RN]
UNII-15108BI2HR
  • Miscellaneous

    • Chemical Class:

      A (2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol that has <stereo>R</stereo> configuration. ChEBI CHEBI:133644
      A (2,4-dichlorophenyl)(phenyl)pyrimidin-5-ylmethanol that has R configuration. ChEBI CHEBI:133644

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

Density: 1.4±0.1 g/cm3
Boiling Point: 501.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±3.0 kJ/mol
Flash Point: 257.2±28.7 °C
Index of Refraction: 1.643
Molar Refractivity: 87.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 148.91
ACD/KOC (pH 5.5): 1250.16
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 148.85
ACD/KOC (pH 7.4): 1249.65
Polar Surface Area: 46 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 57.0±3.0 dyne/cm
Molar Volume: 240.6±3.0 cm3

Click to predict properties on the Chemicalize site


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