ChemSpider 2D Image | (1-Ethyl-3-methyl-1H-pyrazol-5-yl)[7-(4-fluorobenzyl)-2,7-diazaspiro[4.5]dec-2-yl]methanone | C22H29FN4O

(1-Ethyl-3-methyl-1H-pyrazol-5-yl)[7-(4-fluorobenzyl)-2,7-diazaspiro[4.5]dec-2-yl]methanone

  • Molecular FormulaC22H29FN4O
  • Average mass384.490 Da
  • Monoisotopic mass384.232544 Da
  • ChemSpider ID22188774

More details:

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

(1-Ethyl-3-methyl-1H-pyrazol-5-yl)[7-(4-fluorbenzyl)-2,7-diazaspiro[4.5]dec-2-yl]methanon [German] [ACD/IUPAC Name]
(1-Ethyl-3-methyl-1H-pyrazol-5-yl)[7-(4-fluorobenzyl)-2,7-diazaspiro[4.5]dec-2-yl]methanone [ACD/IUPAC Name]
(1-Éthyl-3-méthyl-1H-pyrazol-5-yl)[7-(4-fluorobenzyl)-2,7-diazaspiro[4.5]déc-2-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, (1-ethyl-3-methyl-1H-pyrazol-5-yl)[7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]dec-2-yl]- [ACD/Index Name]
2-[(1-ethyl-3-methyl-1H-pyrazol-5-yl)carbonyl]-7-(4-fluorobenzyl)-2,7-diazaspiro[4.5]decane

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

Density: 1.2±0.1 g/cm3
Boiling Point: 541.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 281.2±30.1 °C
Index of Refraction: 1.616
Molar Refractivity: 109.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.41
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.99
ACD/BCF (pH 7.4): 1.42
ACD/KOC (pH 7.4): 16.38
Polar Surface Area: 41 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 45.1±7.0 dyne/cm
Molar Volume: 313.4±7.0 cm3

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