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Search term: MF = 'C_{9}H_{15}BrN_{2}O'
ChemSpider 2D Image | 4-Bromo-3-(butoxymethyl)-1-methyl-1H-pyrazole | C9H15BrN2O

4-Bromo-3-(butoxymethyl)-1-methyl-1H-pyrazole

  • Molecular FormulaC9H15BrN2O
  • Average mass247.132 Da
  • Monoisotopic mass246.036774 Da
  • ChemSpider ID53606800

More details:

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

1H-Pyrazole, 4-bromo-3-(butoxymethyl)-1-methyl- [ACD/Index Name]
4-Brom-3-(butoxymethyl)-1-methyl-1H-pyrazol [German] [ACD/IUPAC Name]
4-Bromo-3-(butoxymethyl)-1-methyl-1H-pyrazole [ACD/IUPAC Name]
4-Bromo-3-(butoxyméthyl)-1-méthyl-1H-pyrazole [French] [ACD/IUPAC Name]
1856085-09-0 [RN]
4-BROMO-3-(BUTOXYMETHYL)-1-METHYLPYRAZOLE
MFCD29910731

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

Density: 1.4±0.1 g/cm3
Boiling Point: 295.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.3±3.0 kJ/mol
Flash Point: 132.3±23.2 °C
Index of Refraction: 1.540
Molar Refractivity: 57.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.62
ACD/LogD (pH 5.5): 2.87
ACD/BCF (pH 5.5): 89.94
ACD/KOC (pH 5.5): 871.46
ACD/LogD (pH 7.4): 2.87
ACD/BCF (pH 7.4): 89.94
ACD/KOC (pH 7.4): 871.46
Polar Surface Area: 27 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 37.1±7.0 dyne/cm
Molar Volume: 181.7±7.0 cm3

Click to predict properties on the Chemicalize site


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