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Search term: CYGCZVZRSOGLAB (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 3-(7-Bromo-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazol-5-amine | C11H10BrN3O2

3-(7-Bromo-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazol-5-amine

  • Molecular FormulaC11H10BrN3O2
  • Average mass296.120 Da
  • Monoisotopic mass294.995636 Da
  • ChemSpider ID26326205

More details:






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

1H-Pyrazol-5-amine, 3-(7-bromo-1,3-benzodioxol-5-yl)-1-methyl- [ACD/Index Name]
3-(7-Brom-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazol-5-amin [German] [ACD/IUPAC Name]
3-(7-Bromo-1,3-benzodioxol-5-yl)-1-methyl-1H-pyrazol-5-amine [ACD/IUPAC Name]
3-(7-Bromo-1,3-benzodioxol-5-yl)-1-méthyl-1H-pyrazol-5-amine [French] [ACD/IUPAC Name]
AVX

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point: 459.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.0±3.0 kJ/mol
Flash Point: 231.9±28.7 °C
Index of Refraction: 1.735
Molar Refractivity: 64.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.69
ACD/LogD (pH 5.5): 1.85
ACD/BCF (pH 5.5): 14.89
ACD/KOC (pH 5.5): 240.22
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 14.95
ACD/KOC (pH 7.4): 241.20
Polar Surface Area: 62 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 60.8±7.0 dyne/cm
Molar Volume: 161.1±7.0 cm3

Click to predict properties on the Chemicalize site






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