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Search term: QQFIKDACOYRIAM-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | Ethyl 4-[(4-methoxyphenyl)sulfonyl]-4-phenyl-1-piperidinecarboxylate | C21H25NO5S

Ethyl 4-[(4-methoxyphenyl)sulfonyl]-4-phenyl-1-piperidinecarboxylate

  • Molecular FormulaC21H25NO5S
  • Average mass403.492 Da
  • Monoisotopic mass403.145355 Da
  • ChemSpider ID23247677

More details:

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

1-Piperidinecarboxylic acid, 4-[(4-methoxyphenyl)sulfonyl]-4-phenyl-, ethyl ester [ACD/Index Name]
4-[(4-Méthoxyphényl)sulfonyl]-4-phényl-1-pipéridinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-[(4-methoxyphenyl)sulfonyl]-4-phenyl-1-piperidinecarboxylate [ACD/IUPAC Name]
ethyl 4-[(4-methoxyphenyl)sulfonyl]-4-phenylpiperidine-1-carboxylate
Ethyl-4-[(4-methoxyphenyl)sulfonyl]-4-phenyl-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-(4-Methoxy-benzenesulfonyl)-4-phenyl-piperidine-1-carboxylic acid ethyl ester
CHEMBL360740
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL360740/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 578.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.6±3.0 kJ/mol
Flash Point: 303.9±30.1 °C
Index of Refraction: 1.574
Molar Refractivity: 107.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 211.69
ACD/KOC (pH 5.5): 1608.20
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 211.69
ACD/KOC (pH 7.4): 1608.20
Polar Surface Area: 81 Å2
Polarizability: 42.6±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 325.5±3.0 cm3

Click to predict properties on the Chemicalize site


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