ChemSpider 2D Image | (5,6-Dichloro-2-methyl-3-pyridinyl)[3-hydroxy-3-(1H-1,2,3-triazol-4-yl)-1-pyrrolidinyl]methanone | C13H13Cl2N5O2

(5,6-Dichloro-2-methyl-3-pyridinyl)[3-hydroxy-3-(1H-1,2,3-triazol-4-yl)-1-pyrrolidinyl]methanone

  • Molecular FormulaC13H13Cl2N5O2
  • Average mass342.181 Da
  • Monoisotopic mass341.044617 Da
  • ChemSpider ID65051762

More details:

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

(5,6-Dichlor-2-methyl-3-pyridinyl)[3-hydroxy-3-(1H-1,2,3-triazol-4-yl)-1-pyrrolidinyl]methanon [German] [ACD/IUPAC Name]
(5,6-Dichloro-2-methyl-3-pyridinyl)[3-hydroxy-3-(1H-1,2,3-triazol-4-yl)-1-pyrrolidinyl]methanone [ACD/IUPAC Name]
(5,6-Dichloro-2-méthyl-3-pyridinyl)[3-hydroxy-3-(1H-1,2,3-triazol-4-yl)-1-pyrrolidinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (5,6-dichloro-2-methyl-3-pyridinyl)[3-hydroxy-3-(1H-1,2,3-triazol-4-yl)-1-pyrrolidinyl]- [ACD/Index Name]
1-(5,6-dichloro-2-methylpyridine-3-carbonyl)-3-(1H-1,2,3-triazol-4-yl)pyrrolidin-3-ol
2094547-49-4 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 643.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.8±3.0 kJ/mol
Flash Point: 342.9±31.5 °C
Index of Refraction: 1.678
Molar Refractivity: 80.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.21
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.57
ACD/KOC (pH 5.5): 47.95
ACD/LogD (pH 7.4): 0.51
ACD/BCF (pH 7.4): 1.41
ACD/KOC (pH 7.4): 43.33
Polar Surface Area: 95 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 86.1±3.0 dyne/cm
Molar Volume: 214.6±3.0 cm3

Click to predict properties on the Chemicalize site


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