Vitas-M small molecule compound

4-hydroxy-5-methylbenzene-1,3-dicarboxylic acid

Catalog ID
STL511096
SMILES OC(=O)c1cc(C)c(c(c1)C(=O)O)O

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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 C9H8O5 MW 196.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3,(H,11,12)(H,13,14)
InChIKey
OOYWRUIYOUYTGQ-UHFFFAOYSA-N
Synonyms
4365-31-5
13BENZENEDICARBOXYLICACID4HYDROXY5METHYL
228512
4365315
4hydroxy5methylbenzene13dicarboxylicacid
4HYDROXY5METHYLISOPHTHALICACID
InChI=1SC9H8O5c1425(8(11)12)36(7(4)10)9(13)14h2310H1H3(H1112)(H1314)
ISOPHTHALICACID4HYDROXY5METHYL
MFCD02925539
ZINC000004028951
ZINC4028951

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Available files

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