Vitas-M small molecule compound

3,5-di-tert-butyl-4-hydroxybenzyl thiocyanate

Catalog ID
STK525961
SMILES N#CSCc1cc(c(c(c1)C(C)(C)C)O)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 C16H23NOS MW 277.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23NOS/c1-15(2,3)12-7-11(9-19-10-17)8-13(14(12)18)16(4,5)6/h7-8,18H,9H2,1-6H3
InChIKey
GPWXIYJVFVRAAA-UHFFFAOYSA-N
Synonyms
78536-43-3
(35DITERTBUTYL4HYDROXYPHENYL)METHYLTHIOCYANATE
26ditertbutyl4(thiocyanatomethyl)phenol
35ditertbutyl4hydroxybenzylthiocyanate
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CSC#N
PHENOL26DITERTBUTYL4THIOCYANATOMETHYL
Registry IDs
MFCD01877655
ZINC000002272722
ZINC02272722
ZINC2272722

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Available files

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