Vitas-M small molecule compound

(2E)-4-{2-[(3-methylphenyl)carbonyl]hydrazinyl}-4-oxobut-2-enoic acid

Catalog ID
STK120795
SMILES O=C(NNC(=O)c1cccc(c1)C)/C=C/C(=O)O

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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 C12H12N2O4 MW 248.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O4/c1-8-3-2-4-9(7-8)12(18)14-13-10(15)5-6-11(16)17/h2-7H,1H3,(H,13,15)(H,14,18)(H,16,17)/b6-5+
InChIKey
VAHCZPDHUWVIJL-AATRIKPKSA-N
Synonyms
362623-34-5
(2E)4(2((3METHYLPHENYL)CARBONYL)HYDRAZINYL)4OXOBUT2ENOICACID
(2E)4(2(3METHYLBENZOYL)HYDRAZINO)4OXOBUT2ENOICACID
(E)4(2(3METHYLBENZOYL)HYDRAZINYL)4OXOBUT2ENOICACID
362623345
CC1=CC=CC(=C1)C(=O)NNC(=O)C=CC(=O)O
InChI=1SC12H12N2O4c183249(78)12(18)141310(15)5611(16)17h27H1H3(H1315)(H1418)(H1617)b65+
MFCD01209318
O=C(NNC(=O)c1cccc(c1)C)C=CC(=O)O
ZINC000002895704
ZINC2895704

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Available files

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