Vitas-M small molecule compound

methyl 1-(4-nitrophenyl)-4,5-dihydro-1H-1,2,3-triazole-4-carboxylate

Catalog ID
STK753751
SMILES COC(=O)C1N=NN(C1)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 C10H10N4O4 MW 250.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10N4O4/c1-18-10(15)9-6-13(12-11-9)7-2-4-8(5-3-7)14(16)17/h2-5,9H,6H2,1H3
InChIKey
SGEOZVGQACJWTP-UHFFFAOYSA-N
Synonyms

COC(=O)C1CN(N=N1)C2=CC=C(C=C2)(N+)(=O)(O)
COC(=O)C1N=NN(C1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC10H10N4O4c11810(15)9613(12119)7248(537)14(16)17h259H6H21H3
METHYL1(4NITROPHENYL)123TRIAZOLINE4CARBOXYLATE
methyl1(4nitrophenyl)45dihydro1H123triazole4carboxylate
METHYL1(4NITROPHENYL)45DIHYDROTRIAZOLE4CARBOXYLATE
MFCD00824456
ZINC000004142519
ZINC000004142522

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Available files

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