ChemSpider 2D Image | 3-Methoxy-2-pentyl-2H-indazole | C13H18N2O

3-Methoxy-2-pentyl-2H-indazole

  • Molecular FormulaC13H18N2O
  • Average mass218.295 Da
  • Monoisotopic mass218.141907 Da
  • ChemSpider ID34507049

More details:

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

2H-Indazole, 3-methoxy-2-pentyl- [ACD/Index Name]
3-Methoxy-2-pentyl-2H-indazol [German] [ACD/IUPAC Name]
3-Methoxy-2-pentyl-2H-indazole [ACD/IUPAC Name]
3-Méthoxy-2-pentyl-2H-indazole [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL3343333/

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

Density: 1.1±0.1 g/cm3
Boiling Point: 355.8±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 57.7±3.0 kJ/mol
Flash Point: 169.0±20.4 °C
Index of Refraction: 1.550
Molar Refractivity: 65.4±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 309.96
ACD/KOC (pH 5.5): 2101.73
ACD/LogD (pH 7.4): 3.59
ACD/BCF (pH 7.4): 315.74
ACD/KOC (pH 7.4): 2140.88
Polar Surface Area: 27 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 36.7±7.0 dyne/cm
Molar Volume: 205.1±7.0 cm3

Click to predict properties on the Chemicalize site


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