Vitas-M small molecule compound

(2,4,5-trimethylphenyl)acetic acid

Catalog ID
STK891554
SMILES OC(=O)Cc1cc(C)c(cc1C)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 C11H14O2 MW 178.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H14O2/c1-7-4-9(3)10(5-8(7)2)6-11(12)13/h4-5H,6H2,1-3H3,(H,12,13)
InChIKey
NGJKVDNPUSPLQE-UHFFFAOYSA-N
Synonyms

(245trimethylphenyl)aceticacid
2(245TRIMETHYLPHENYL)ACETICACID
245TRIMETHYLPHENYLACETICACID
BENZENEACETICACID245TRIMETHYL
CC1=CC(=C(C=C1C)CC(=O)O)C
InChI=1SC11H14O2c1749(3)10(58(7)2)611(12)13h45H6H213H3(H1213)
MFCD02664689
ZINC000003750720
ZINC3750720

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Available files

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