Vitas-M small molecule compound
2-{[(4,4,5,5,5-pentafluoropentyl)oxy]carbonyl}benzoic acid
Catalog ID
STK001639
SMILES O=C(c1ccccc1C(=O)O)OCCCC(C(F)(F)F)(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H11F5O4 MW 326.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11F5O4/c14-12(15,13(16,17)18)6-3-7-22-11(21)9-5-2-1-4-8(9)10(19)20/h1-2,4-5H,3,6-7H2,(H,19,20)InChIKey
UKGIEAZBRIUEFZ-UHFFFAOYSA-NSynonyms
303133-78-02(((44555pentafluoropentyl)oxy)carbonyl)benzoicacid
2(44555pentafluoropentoxycarbonyl)benzoicacid
303133780
C1=CC=C(C(=C1)C(=O)O)C(=O)OCCCC(C(F)(F)F)(F)F
InChI=1SC13H11F5O4c1412(1513(1617)18)6372211(21)952148(9)10(19)20h1245H367H2(H1920)
MFCD00814835
O=C(c1ccccc1C(=O)O)OCCCC(C(F)(F)F)(F)F
STK001639
ZINC000002070754
ZINC2070754
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