ChemSpider 2D Image | Ethyl (1',5,5'-trimethyl-1H,1'H-3,3'-bipyrazol-1-yl)acetate | C13H18N4O2

Ethyl (1',5,5'-trimethyl-1H,1'H-3,3'-bipyrazol-1-yl)acetate

  • Molecular FormulaC13H18N4O2
  • Average mass262.308 Da
  • Monoisotopic mass262.142975 Da
  • ChemSpider ID21126437

More details:

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

(1',5,5'-Triméthyl-1H,1'H-3,3'-bipyrazol-1-yl)acétate d'éthyle [French] [ACD/IUPAC Name]
[3,3'-Bi-1H-pyrazole]-1-acetic acid, 1',5,5'-trimethyl-, ethyl ester [ACD/Index Name]
Ethyl (1',5,5'-trimethyl-1H,1'H-3,3'-bipyrazol-1-yl)acetate [ACD/IUPAC Name]
Ethyl-(1',5,5'-trimethyl-1H,1'H-3,3'-bipyrazol-1-yl)acetat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 387.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.6±3.0 kJ/mol
Flash Point: 187.9±27.9 °C
Index of Refraction: 1.589
Molar Refractivity: 72.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.73
ACD/LogD (pH 5.5): 2.10
ACD/BCF (pH 5.5): 23.34
ACD/KOC (pH 5.5): 331.83
ACD/LogD (pH 7.4): 2.10
ACD/BCF (pH 7.4): 23.34
ACD/KOC (pH 7.4): 331.84
Polar Surface Area: 62 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 41.6±7.0 dyne/cm
Molar Volume: 216.2±7.0 cm3

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