Vitas-M small molecule compound

2-bromo-4-formyl-6-methoxyphenyl tricyclo[3.3.1.1~3,7~]decane-1-carboxylate

Catalog ID
STK392713
SMILES O=Cc1cc(Br)c(c(c1)OC)OC(=O)C12CC3CC(C2)CC(C1)C3

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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 C19H21BrO4 MW 393.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21BrO4/c1-23-16-6-14(10-21)5-15(20)17(16)24-18(22)19-7-11-2-12(8-19)4-13(3-11)9-19/h5-6,10-13H,2-4,7-9H2,1H3
InChIKey
ZOOARNLDLORLKZ-UHFFFAOYSA-N
Synonyms
309936-78-5
(2BROMO4FORMYL6METHOXYPHENYL)ADAMANTANE1CARBOXYLATE
2BROMO4FORMYL6METHOXYPHENYLADAMANTANECARBOXYLATE
2bromo4formyl6methoxyphenyltricyclo(3311~37~)decane1carboxylate
309936785
COC1=C(C(=CC(=C1)C=O)Br)OC(=O)C23CC4CC(C2)CC(C4)C3
InChI=1SC19H21BrO4c12316614(1021)515(20)17(16)2418(22)19711212(819)413(311)919h561013H2479H21H3
MFCD01963801
ZINC000004505805
ZINC04505805
ZINC4505805

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Available files

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