Vitas-M small molecule compound

4'-(octyloxy)biphenyl-4-carboxylic acid

Catalog ID
STK059488
SMILES CCCCCCCCOc1ccc(cc1)c1ccc(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 C21H26O3 MW 326.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26O3/c1-2-3-4-5-6-7-16-24-20-14-12-18(13-15-20)17-8-10-19(11-9-17)21(22)23/h8-15H,2-7,16H2,1H3,(H,22,23)
InChIKey
YNBBQLUKHHSKPW-UHFFFAOYSA-N
Synonyms
59748-18-4
(11BIPHENYL)4CARBOXYLICACID4(OCTYLOXY)
4(4(OCTYLOXY)PHENYL)BENZOICACID
4(4OCTOXYPHENYL)BENZOICACID
4(4OCTYLOXYPHENYL)BENZOICACID
4(OCTYLOXY)(11BIPHENYL)4CARBOXYLICACID
4(OCTYLOXY)4BIPHENYLCARBOXYLICACID
4(OCTYLOXY)BIPHENYL4CARBOXYLICACID
4INVERTEDEXCLAMATIONMARKA(OCTYLOXY)4BIPHENYLCARBOXYLICACID
4NOCTYLOXY(11BIPHENYL)4YLCARBOXYLICACID
4NOCTYLOXYBIPHENYL4CARBOXYLICACID
4OCTYLOXY4BIPHENYLCARBOXYLICACID
4OCTYLOXYBIPHENYL4CARBOXYLICACID
59748184
CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
CCCCCCCCOc1ccc(cc1)c1ccc(cc1)C(=O)O
InChI=1SC21H26O3c1234567162420141218(131520)1781019(11917)21(22)23h815H2716H21H3(H2223)
MFCD00192369
STK059488
ZINC000002557057
ZINC2557057

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Available files

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