Vitas-M small molecule compound

4-(azepan-1-ylmethyl)-2,6-di-tert-butylphenol

Catalog ID
STK667654
SMILES CC(c1cc(CN2CCCCCC2)cc(c1O)C(C)(C)C)(C)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 C21H35NO MW 317.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H35NO/c1-20(2,3)17-13-16(14-18(19(17)23)21(4,5)6)15-22-11-9-7-8-10-12-22/h13-14,23H,7-12,15H2,1-6H3
InChIKey
LCPBHCJDIYPASC-UHFFFAOYSA-N
Synonyms

4(AZAPERHYDROEPINYLMETHYL)26BIS(TERTBUTYL)PHENOL
4(azepan1ylmethyl)26ditertbutylphenol
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CN2CCCCCC2
InChI=1SC21H35NOc120(23)171316(1418(19(17)23)21(45)6)152211978101222h131423H71215H216H3
MFCD00600813
ZINC000002023784
ZINC2023784

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Available files

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