Vitas-M small molecule compound

(3-nitro-1H-1,2,4-triazol-1-yl)acetic acid

Catalog ID
STK353621
SMILES OC(=O)Cn1cnc(n1)[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 C4H4N4O4 MW 172.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C4H4N4O4/c9-3(10)1-7-2-5-4(6-7)8(11)12/h2H,1H2,(H,9,10)
InChIKey
JNJSKDYVVRMEPN-UHFFFAOYSA-N
Synonyms
116419-36-4
(3NITRO(124)TRIAZOL1YL)ACETICACID
(3NITRO124TRIAZOL1YL)ACETICACID
(3nitro1H124triazol1yl)aceticacid
116419364
1CARBOXYMETHYL3NITRO124TRIAZOLE
1H124TRIAZOLE1ACETICACID3NITRO
2(3NITRO124TRIAZOL1YL)ACETICACID
2(3NITRO124TRIAZOLYL)ACETICACID
2(3NITRO1H124TRIAZOL1YL)ACETICACID
3NITRO1H124TRIAZOLE1ACETICACID
C1=NC(=NN1CC(=O)O)(N+)(=O)(O)
InChI=1SC4H4N4O4c93(10)17254(67)8(11)12h2H1H2(H910)
MFCD00297307
OC(=O)Cn1cnc(n1)(N+)(=O)(O)
ZINC000003909520
ZINC3909520

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Available files

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