Vitas-M small molecule compound

bis(3,3'-dimethylbiphenyl-4-yl) benzene-1,3-dicarboxylate

Catalog ID
STK369095
SMILES Cc1cccc(c1)c1ccc(c(c1)C)OC(=O)c1cccc(c1)C(=O)Oc1ccc(cc1C)c1cccc(c1)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 C36H30O4 MW 526.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30O4/c1-23-8-5-10-27(18-23)29-14-16-33(25(3)20-29)39-35(37)31-12-7-13-32(22-31)36(38)40-34-17-15-30(21-26(34)4)28-11-6-9-24(2)19-28/h5-22H,1-4H3
InChIKey
METNMLAKFGJHOV-UHFFFAOYSA-N
Synonyms

2METHYL4(3METHYLPHENYL)PHENYL3((2METHYL4(3METHYLPHENYL)PHENYL)OXYCARBONYL)BENZOATE
BIS(2METHYL4(3METHYLPHENYL)PHENYL)BENZENE13DICARBOXYLATE
bis(33dimethylbiphenyl4yl)benzene13dicarboxylate
CC1=CC=CC(=C1)C2=CC(=C(C=C2)OC(=O)C3=CC(=CC=C3)C(=O)OC4=C(C=C(C=C4)C5=CC(=CC=C5)C)C)C
InChI=1SC36H30O4c123851027(1823)29141633(25(3)2029)3935(37)311271332(2231)36(38)4034171530(2126(34)4)28116924(2)1928h522H14H3
MFCD00311688
ZINC000002026333
ZINC02026333
ZINC2026333

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Available files

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