Secondary metabolite:Octadecyl pentafluoropropanoate



EOCID002076
Summary

sCentInDB Chemical identifier: EOCID002076

Chemical name: Octadecyl pentafluoropropanoate

Molecular formula: C21H37F5O2

SMILES: CCCCCCCCCCCCCCCCCCOC(=O)C(C(F)(F)F)(F)F

InChI: InChI=1S/C21H37F5O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-28-19(27)20(22,23)21(24,25)26/h2-18H2,1H3

InChIKey: KNCMVQBRQJKYNM-UHFFFAOYSA-N


Chemical classification

Kingdom: Organic compounds

Superclass: Organohalogen compounds

Class: Alkyl halides

Subclass: Alkyl fluorides


Synonymous chemical name(s):
octadecyl ester pentafluoropropionic acid


External chemical identifier(s):
CHEMSPIDER:467949


Chemical structure download

2D:
2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT
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