Vitas-M small molecule compound

2-[3-fluoro-4-(octyloxy)phenyl]-5-octylpyridine

Catalog ID
STK090227
SMILES CCCCCCCCOc1ccc(cc1F)c1ccc(cn1)CCCCCCCC

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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 C27H40FNO MW 413.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H40FNO/c1-3-5-7-9-11-13-15-23-16-18-26(29-22-23)24-17-19-27(25(28)21-24)30-20-14-12-10-8-6-4-2/h16-19,21-22H,3-15,20H2,1-2H3
InChIKey
KGFCOUVEOVMWSR-UHFFFAOYSA-N
Synonyms
115573-70-1
115573701
2(3FLUORO4(OCTYLOXY)PHENYL)5OCTYLPYRIDINE
2(3FLUORO4OCTOXYPHENYL)5OCTYLPYRIDINE
2(3FLUORO4OCTYLOXYPHENYL)5OCTYLPYRIDINE
CCCCCCCCC1=CN=C(C=C1)C2=CC(=C(C=C2)OCCCCCCCC)F
CCCCCCCCOc1ccc(cc1F)c1ccc(cn1)CCCCCCCC
InChI=1SC27H40FNOc1357911131523161826(292223)24171927(25(28)2124)30201412108642h16192122H31520H212H3
MFCD00691440
STK090227
ZINC000097949686
ZINC97949686

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Available files

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