Vitas-M small molecule compound

2-(4-tert-butylphenyl)-6,8-dimethylquinoline-4-carboxylic acid

Catalog ID
STK439810
SMILES Cc1cc(C)c2c(c1)c(cc(n2)c1ccc(cc1)C(C)(C)C)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 C22H23NO2 MW 333.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO2/c1-13-10-14(2)20-17(11-13)18(21(24)25)12-19(23-20)15-6-8-16(9-7-15)22(3,4)5/h6-12H,1-5H3,(H,24,25)
InChIKey
PPDVWLBSLJOYDQ-UHFFFAOYSA-N
Synonyms
590356-79-9
2(4(TERTBUTYL)PHENYL)68DIMETHYLQUINOLINE4CARBOXYLICACID
2(4tertbutylphenyl)68dimethylquinoline4carboxylicacid
590356799
CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)C(C)(C)C)C(=O)O)C
InChI=1SC22H23NO2c1131014(2)2017(1113)18(21(24)25)1219(2320)156816(9715)22(34)5h612H15H3(H2425)
MFCD03420068
ZINC000003756477
ZINC3756477

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Available files

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