Vitas-M small molecule compound
(1-methyl-3-nitro-1H-pyrazol-5-yl)acetonitrile
Catalog ID
STL415035
SMILES [O-][N+](=O)c1cc(n(n1)C)CC#N
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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 C6H6N4O2 MW 166.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H6N4O2/c1-9-5(2-3-7)4-6(8-9)10(11)12/h4H,2H2,1H3InChIKey
XAKKZGDNWLSKKN-UHFFFAOYSA-NSynonyms
1260659-25-3(1methyl3nitro1Hpyrazol5yl)acetonitrile
(O)(N+)(=O)c1cc(n(n1)C)CC#N
1260659253
2(1METHYL3NITROPYRAZOL5YL)ETHANENITRILE
2(2methyl5nitropyrazol3yl)acetonitrile
CN1C(=CC(=N1)(N+)(=O)(O))CC#N
InChI=1SC6H6N4O2c195(237)46(89)10(11)12h4H2H21H3
MFCD18262401
ZINC000072209548
ZINC72209548
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