ChemSpider 2D Image | (4-Bromo-3-isopropyl-1H-pyrazol-5-yl)(3-ethoxy-1-piperidinyl)methanone | C14H22BrN3O2

(4-Bromo-3-isopropyl-1H-pyrazol-5-yl)(3-ethoxy-1-piperidinyl)methanone

  • Molecular FormulaC14H22BrN3O2
  • Average mass344.247 Da
  • Monoisotopic mass343.089539 Da
  • ChemSpider ID30358065

More details:

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

(4-Brom-3-isopropyl-1H-pyrazol-5-yl)(3-ethoxy-1-piperidinyl)methanon [German] [ACD/IUPAC Name]
(4-Bromo-3-isopropyl-1H-pyrazol-5-yl)(3-ethoxy-1-piperidinyl)methanone [ACD/IUPAC Name]
(4-Bromo-3-isopropyl-1H-pyrazol-5-yl)(3-éthoxy-1-pipéridinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [4-bromo-3-(1-methylethyl)-1H-pyrazol-5-yl](3-ethoxy-1-piperidinyl)- [ACD/Index Name]
1-(4-BROMO-5-ISOPROPYL-2H-PYRAZOLE-3-CARBONYL)-3-ETHOXYPIPERIDINE
1-[4-BROMO-3-(PROPAN-2-YL)-1H-PYRAZOLE-5-CARBONYL]-3-ETHOXYPIPERIDINE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 497.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 254.7±28.7 °C
Index of Refraction: 1.566
Molar Refractivity: 80.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.98
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 19.17
ACD/KOC (pH 5.5): 288.25
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 19.17
ACD/KOC (pH 7.4): 288.25
Polar Surface Area: 58 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 247.6±5.0 cm3

Click to predict properties on the Chemicalize site


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