Vitas-M small molecule compound

(2E,6E)-2,6-bis(3-bromobenzylidene)-4-tert-butylcyclohexanone

Catalog ID
STK760279
SMILES Brc1cccc(c1)/C=C/1\CC(C/C(=C\c2cccc(c2)Br)/C1=O)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 C24H24Br2O MW 488.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24Br2O/c1-24(2,3)20-14-18(10-16-6-4-8-21(25)12-16)23(27)19(15-20)11-17-7-5-9-22(26)13-17/h4-13,20H,14-15H2,1-3H3/b18-10+,19-11+
InChIKey
ATLUOQDMBOFITO-XOBNHNQQSA-N
Synonyms

(2E6E)26BIS((3BROMOPHENYL)METHYLIDENE)4TERTBUTYLCYCLOHEXAN1ONE
(2E6E)26bis(3bromobenzylidene)4tertbutylcyclohexanone
Brc1cccc(c1)C=C1CC(CC(=Cc2cccc(c2)Br)C1=O)C(C)(C)C
CC(C)(C)C1CC(=CC2=CC(=CC=C2)Br)C(=O)C(=CC3=CC(=CC=C3)Br)C1
InChI=1SC24H24Br2Oc124(23)201418(101664821(25)1216)23(27)19(1520)111775922(26)1317h41320H1415H213H3b1810+1911+
MFCD01204723
ZINC000008854495
ZINC08854495
ZINC39376918
ZINC8854495

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Available files

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