Vitas-M small molecule compound

4-ethylbenzoic acid

Catalog ID
STL168364
SMILES CCc1ccc(cc1)C(=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 C9H10O2 MW 150.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H10O2/c1-2-7-3-5-8(6-4-7)9(10)11/h3-6H,2H2,1H3,(H,10,11)
InChIKey
ZQVKTHRQIXSMGY-UHFFFAOYSA-N
Synonyms
619-64-7
4ETHYLBENZOATE
4ethylbenzoicacid
619647
BENZOICACID4ETHYL
CCC1=CC=C(C=C1)C(=O)O
InChI=1SC9H10O2c127358(647)9(10)11h36H2H21H3(H1011)
MFCD00002570
PETHYLBENZOATE
PETHYLBENZOICACID
ZINC000000132913
ZINC132913

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Available files

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