Vitas-M small molecule compound

4-(2,2-dimethylpropoxy)benzoic acid

Catalog ID
STL069275
SMILES OC(=O)c1ccc(cc1)OCC(C)(C)C

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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 C12H16O3 MW 208.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16O3/c1-12(2,3)8-15-10-6-4-9(5-7-10)11(13)14/h4-7H,8H2,1-3H3,(H,13,14)
InChIKey
VZGBFUCAXPSHOP-UHFFFAOYSA-N
Synonyms
355391-06-9
355391069
4(22dimethylpropoxy)benzoicacid
4(NEOPENTYLOXY)BENZOICACID
CC(C)(C)COC1=CC=C(C=C1)C(=O)O
InChI=1SC12H16O3c112(23)81510649(5710)11(13)14h47H8H213H3(H1314)
MFCD06801152
ZINC000012138098
ZINC12138098

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Available files

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