Vitas-M small molecule compound

4,7-di-tert-butyl-1,3-benzodioxole

Catalog ID
STL326583
SMILES CC(c1ccc(c2c1OCO2)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 C15H22O2 MW 234.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22O2/c1-14(2,3)10-7-8-11(15(4,5)6)13-12(10)16-9-17-13/h7-8H,9H2,1-6H3
InChIKey
XHNZBOQQCNCBBC-UHFFFAOYSA-N
Synonyms
76588-54-0
13BENZODIOXOLE47BIS(11DIMETHYLETHYL)
47ditertbutyl13benzodioxole
47ditertbutylbenzo(d)(13)dioxole
76588540
CC(C)(C)C1=C2C(=C(C=C1)C(C)(C)C)OCO2
InChI=1SC15H22O2c114(23)107811(15(45)6)1312(10)1691713h78H9H216H3
MFCD00515105
ZINC000000500937
ZINC00500937
ZINC500937

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Available files

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