Vitas-M small molecule compound

(2E)-1-(4-bromophenyl)-3-(1-methyl-1H-pyrazol-4-yl)prop-2-en-1-one

Catalog ID
STK309767
SMILES Brc1ccc(cc1)C(=O)/C=C/c1cnn(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 C13H11BrN2O MW 291.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11BrN2O/c1-16-9-10(8-15-16)2-7-13(17)11-3-5-12(14)6-4-11/h2-9H,1H3/b7-2+
InChIKey
SRRPIDJILISRGB-FARCUNLSSA-N
Synonyms
1005584-68-8
(2E)1(4bromophenyl)3(1methyl1Hpyrazol4yl)prop2en1one
(E)1(4bromophenyl)3(1methylpyrazol4yl)prop2en1one
1005584688
Brc1ccc(cc1)C(=O)C=Cc1cnn(c1)C
CN1C=C(C=N1)C=CC(=O)C2=CC=C(C=C2)Br
InChI=1SC13H11BrN2Oc116910(81516)2713(17)113512(14)6411h29H1H3b72+
MFCD04133864
ZINC000006925501
ZINC06925501
ZINC6925501

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Available files

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