Vitas-M small molecule compound
2,6-di-tert-butyl-4-(dichloromethyl)-4-methylcyclohexa-2,5-dien-1-one
Catalog ID
STK076138
SMILES ClC(C1(C)C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C)Cl
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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 C16H24Cl2O MW 303.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24Cl2O/c1-14(2,3)10-8-16(7,13(17)18)9-11(12(10)19)15(4,5)6/h8-9,13H,1-7H3InChIKey
LJEFTNVYDZZYTA-UHFFFAOYSA-NSynonyms
54537-87-026DITERTBUTYL4(DICHLOROMETHYL)4METHYLCYCLOHEXA25DIEN1ONE
26ditertbutyl4(dichloromethyl)4methylcyclohexa25dienone
54537870
CC1(C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C)C(Cl)Cl
ClC(C1(C)C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C)Cl
InChI=1SC16H24Cl2Oc114(23)10816(713(17)18)911(12(10)19)15(45)6h8913H17H3
MFCD00756798
STK076138
ZINC000000042950
ZINC00042950
ZINC42950
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