Vitas-M small molecule compound

5-methyl-2-(4-nitrophenyl)-1,2-dihydro-3H-pyrazol-3-one

Catalog ID
STK398267
SMILES Cc1cc(=O)n([nH]1)c1ccc(cc1)[N+](=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 C10H9N3O3 MW 219.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9N3O3/c1-7-6-10(14)12(11-7)8-2-4-9(5-3-8)13(15)16/h2-6,11H,1H3
InChIKey
RPUNZAYBJWRPCQ-UHFFFAOYSA-N
Synonyms
35496-23-2
1(4NITROPHENYL)3METHYL5PYRAZOLONE
1(PNITROPHENYL)3METHYL5PYRAZOLONE
35496232
3HPYRAZOL3ONE24DIHYDRO5METHYL2(4NITROPHENYL)
3METHYL1(4NITROPHENYL)3PYRAZOLIN5ONE
3METHYL1(4NITROPHENYL)PYRAZOL5OL
5methyl2(4nitrophenyl)12dihydro3Hpyrazol3one
5METHYL2(4NITROPHENYL)1HPYRAZOL3(2H)ONE
5METHYL2(4NITROPHENYL)1HPYRAZOL3ONE
5METHYL2(4NITROPHENYL)2HPYRAZOL3OL
5METHYL2(4NITROPHENYL)4PYRAZOLINE3ONE
CC1=CC(=O)N(N1)C2=CC=C(C=C2)(N+)(=O)(O)
Cc1cc(=O)n((nH)1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC10H9N3O3c17610(14)12(117)8249(538)13(15)16h2611H1H3
MFCD00070620
ZINC000095626698
ZINC04284414
ZINC100004314
ZINC95626698

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.