Vitas-M small molecule compound

2-(phenylsulfanyl)cyclohexa-2,5-diene-1,4-dione

Catalog ID
STK337938
SMILES O=C1C=CC(=O)C=C1Sc1ccccc1

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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 C12H8O2S MW 216.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H8O2S/c13-9-6-7-11(14)12(8-9)15-10-4-2-1-3-5-10/h1-8H
InChIKey
JRXZLRYQEYLRQH-UHFFFAOYSA-N
Synonyms
18232-03-6
18232036
2(PHENYLSULFANYL)BENZO14QUINONE
2(phenylsulfanyl)cyclohexa25diene14dione
2(phenylthio)cyclohexa25diene14dione
2(PHENYLTHIO)PBENZOQUINONE
24DIONE2(PHENYLTHIO)
25CYCLOHEXADIENE14DIONE2(PHENYLTHIO)
2PHENYLSULFANYLCYCLOHEXA25DIENE14DIONE
2PHENYLTHIOCYCLOHEXA25DIENE14DIONE
C1=CC=C(C=C1)SC2=CC(=O)C=CC2=O
InChI=1SC12H8O2Sc1396711(14)12(89)15104213510h18H
MFCD01102873
PBENZOQUINONE2(PHENYLTHIO)
PHENYLTHIOBENZOQUINONE
ZINC000001595277
ZINC1595277

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Available files

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