Vitas-M small molecule compound

(2-bromo-4-tert-butylphenoxy)acetic acid

Catalog ID
STL066175
SMILES OC(=O)COc1ccc(cc1Br)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 C12H15BrO3 MW 287.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15BrO3/c1-12(2,3)8-4-5-10(9(13)6-8)16-7-11(14)15/h4-6H,7H2,1-3H3,(H,14,15)
InChIKey
PJNXDLJWFAAMPA-UHFFFAOYSA-N
Synonyms
117947-05-4
(2bromo4tertbutylphenoxy)aceticacid
117947054
2(2BROMO4(TERTBUTYL)PHENOXY)ACETICACID
2(2BROMO4TERTBUTYLPHENOXY)ACETICACID
2(4(TERTBUTYL)2BROMOPHENOXY)ACETICACID
2BROMO4TERTBUTYLPHENOXYACETICACID
CC(C)(C)C1=CC(=C(C=C1)OCC(=O)O)Br
InChI=1SC12H15BrO3c112(23)84510(9(13)68)16711(14)15h46H7H213H3(H1415)
MFCD07187806
ZINC000001602249
ZINC1602249

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Available files

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