Vitas-M small molecule compound

2-chloro-5-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid

Catalog ID
STK392868
SMILES CC1=NN(C(=O)C1)c1ccc(c(c1)C(=O)O)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 C11H9ClN2O3 MW 252.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H9ClN2O3/c1-6-4-10(15)14(13-6)7-2-3-9(12)8(5-7)11(16)17/h2-3,5H,4H2,1H3,(H,16,17)
InChIKey
GBEPLFGTVCECGW-UHFFFAOYSA-N
Synonyms

2CHLORO5(3METHYL5OXO(2PYRAZOLINYL))BENZOICACID
2CHLORO5(3METHYL5OXO45DIHYDRO1HPYRAZOL1YL)BENZOICACID
2CHLORO5(3METHYL5OXO45DIHYDROPYRAZOL1YL)BENZOICACID
2chloro5(3methyl5oxo4Hpyrazol1yl)benzoicacid
CC1=NN(C(=O)C1)C2=CC(=C(C=C2)Cl)C(=O)O
InChI=1SC11H9ClN2O3c16410(15)14(136)7239(12)8(57)11(16)17h235H4H21H3(H1617)
MFCD01158507
ZINC000000290382
ZINC290382

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Available files

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