Vitas-M small molecule compound

4,4,8,8-tetrachloro-6-(2-methylphenyl)-1,3-diphenyl-2-oxatricyclo[5.1.0.0~3,5~]octane

Catalog ID
STK792736
SMILES Cc1ccccc1C1C2C(C2(Cl)Cl)(OC2(C1C2(Cl)Cl)c1ccccc1)c1ccccc1

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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 C26H20Cl4O MW 490.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20Cl4O/c1-16-10-8-9-15-19(16)20-21-23(25(21,27)28,17-11-4-2-5-12-17)31-24(22(20)26(24,29)30)18-13-6-3-7-14-18/h2-15,20-22H,1H3
InChIKey
YHVRYBGHWQMKOI-UHFFFAOYSA-N
Synonyms

4488tetrachloro13diphenyl6(otolyl)2oxatricyclo(5100(35))octane
4488tetrachloro6(2methylphenyl)13diphenyl2oxatricyclo(5100~35~)octane
CC1=CC=CC=C1C2C3C(C3(Cl)Cl)(OC4(C2C4(Cl)Cl)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC26H20Cl4Oc11610891519(16)202123(25(2127)2817114251217)3124(22(20)26(2429)30)18136371418h2152022H1H3
MFCD01179365
ZINC000002157082
ZINC000239433690

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Available files

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