Found 9 results

Search term: MF = 'C_{21}H_{36}N_{3}O_{5}P'
ChemSpider 2D Image | 2-Methyl-2-propanyl 4-[3-cyclobutyl-4-(diethoxyphosphoryl)-1H-pyrazol-1-yl]-1-piperidinecarboxylate | C21H36N3O5P

2-Methyl-2-propanyl 4-[3-cyclobutyl-4-(diethoxyphosphoryl)-1H-pyrazol-1-yl]-1-piperidinecarboxylate

  • Molecular FormulaC21H36N3O5P
  • Average mass441.501 Da
  • Monoisotopic mass441.239258 Da
  • ChemSpider ID122626927

More details:

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

1-Piperidinecarboxylic acid, 4-[3-cyclobutyl-4-(diethoxyphosphinyl)-1H-pyrazol-1-yl]-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-[3-cyclobutyl-4-(diethoxyphosphoryl)-1H-pyrazol-1-yl]-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-[3-cyclobutyl-4-(diethoxyphosphoryl)-1H-pyrazol-1-yl]-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-[3-Cyclobutyl-4-(diéthoxyphosphoryl)-1H-pyrazol-1-yl]-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 541.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 281.4±30.1 °C
Index of Refraction: 1.578
Molar Refractivity: 115.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 3.14
ACD/BCF (pH 5.5): 144.71
ACD/KOC (pH 5.5): 1224.86
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 144.71
ACD/KOC (pH 7.4): 1224.90
Polar Surface Area: 93 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 46.9±7.0 dyne/cm
Molar Volume: 346.7±7.0 cm3

Click to predict properties on the Chemicalize site


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