2-[3,3,3-tris(fluoranyl)prop-1-en-2-yl]hexanoic acid

Systemtic Name: 2-[3,3,3-tris(fluoranyl)prop-1-en-2-yl]hexanoic acid Openeye Name: 2-[1-(trifluoromethyl)vinyl]hexanoic acid CAS Name: 2-(3,3,3-trifluoroprop-1-en-2-yl)hexanoic acid IUPAC Name: 2-(3,3,3-trifluoroprop-1-en-2-yl)hexanoic acid Traditional Name: 2-butyl-3-(trifluoromethyl)but-3-enoic acid Formula: C9H13F3O2 MolecularWeight: 210.19353

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=C)C(F)(F)F)C(=O)O

Isomeric SMILES

CCCCC(C(=C)C(F)(F)F)C(=O)O

InChI

InChI=1S/C9H13F3O2/c1-3-4-5-7(8(13)14)6(2)9(10,11)12/h7H,2-5H2,1H3,(H,13,14)