Chemical Properties of Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, heptyl ester

Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, heptyl ester

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InChI
InChI=1S/C22H27F6NO3/c1-2-3-4-5-6-13-32-20(31)15-9-11-29(12-10-15)19(30)17-14-16(21(23,24)25)7-8-18(17)22(26,27)28/h7-8,14-15H,2-6,9-13H2,1H3
InChI Key
XOENFNZGAZQTKH-UHFFFAOYSA-N
Formula
C22H27F6NO3
SMILES
CCCCCCCOC(=O)C1CCN(C(=O)c2cc(C(F)(F)F)ccc2C(F)(F)F)CC1
Molecular Weight1
467.45
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Physical Properties

Property Value Unit Source
log10WS -6.94 Crippen Calculated Property
logPoct/wat 6.090 Crippen Calculated Property
McVol 315.830 ml/mol McGowan Calculated Property
Inp [2470.00; 2470.00]   Show Hide
Inp 2470.00 NIST
Inp 2470.00 NIST

Similar Compounds

Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, hexadecyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, tetradecyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, pentadecyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, octyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, nonyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, hexyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, undecyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, decyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, dodecyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, heptadecyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, tridecyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, pentyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, isohexyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, butyl ester. Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, propyl ester.

Find more compounds similar to Isonipecotic acid, N-(2,5-di(trifluoromethyl)benzoyl)-, heptyl ester.

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