Vitas-M small molecule compound

2-methoxy-4-(trifluoromethyl)benzoic acid

Catalog ID
STK664783
SMILES COc1cc(ccc1C(=O)O)C(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 C9H7F3O3 MW 220.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7F3O3/c1-15-7-4-5(9(10,11)12)2-3-6(7)8(13)14/h2-4H,1H3,(H,13,14)
InChIKey
QWRIRBUKLBWVNF-UHFFFAOYSA-N
Synonyms
448-36-2
2CARBOXY5(TRIFLUOROMETHYL)ANISOLE
2methoxy4(trifluoromethyl)benzoicacid
2METHOXY4TRIFLUOROMETHYLBENZOICACID
4(TRIFLUOROMETHYL)2METHOXYBENZOICACID
448362
4CARBOXY3METHOXYBENZOTRIFLUORIDE
BENZOICACID2METHOXY4(TRIFLUOROMETHYL)
COC1=C(C=CC(=C1)C(F)(F)F)C(=O)O
InChI=1SC9H7F3O3c115745(9(1011)12)236(7)8(13)14h24H1H3(H1314)
MFCD04115976
ZINC000002528359
ZINC2528359

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.