Vitas-M small molecule compound

2-(4-bromophenyl)-2-oxoethyl 4-[(1-hydroxycyclohexyl)ethynyl]benzoate

Catalog ID
STK234921
SMILES O=C(c1ccc(cc1)C#CC1(O)CCCCC1)OCC(=O)c1ccc(cc1)Br

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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 C23H21BrO4 MW 441.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrO4/c24-20-10-8-18(9-11-20)21(25)16-28-22(26)19-6-4-17(5-7-19)12-15-23(27)13-2-1-3-14-23/h4-11,27H,1-3,13-14,16H2
InChIKey
MSTIFNHXQYWWQQ-UHFFFAOYSA-N
Synonyms

(2(4BROMOPHENYL)2OXOETHYL)4(2(1HYDROXYCYCLOHEXYL)ETHYNYL)BENZOATE
2(4bromophenyl)2oxoethyl4((1hydroxycyclohexyl)ethynyl)benzoate
2(4BROMOPHENYL)2OXOETHYL4(2(HYDROXYCYCLOHEXYL)ETHYNYL)BENZOATE
C1CCC(CC1)(C#CC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)O
InChI=1SC23H21BrO4c242010818(91120)21(25)162822(26)196417(5719)121523(27)132131423h41127H13131416H2
MFCD02210842
ZINC000008854816
ZINC08854816
ZINC8854816

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Available files

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