Vitas-M small molecule compound

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

Catalog ID
STK349504
SMILES OC(=O)CCn1cnc(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 C5H6N4O4 MW 186.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H6N4O4/c10-4(11)1-2-8-3-6-5(7-8)9(12)13/h3H,1-2H2,(H,10,11)
InChIKey
KKCPKIOXVIYZME-UHFFFAOYSA-N
Synonyms
159209-58-2
159209582
3(3nitro124triazol1yl)propanoicacid
3(3NITRO124TRIAZOLYL)PROPANOICACID
3(3nitro1H124triazol1yl)propanoicacid
C1=NC(=NN1CCC(=O)O)(N+)(=O)(O)
InChI=1SC5H6N4O4c104(11)128365(78)9(12)13h3H12H2(H1011)
MFCD04969185
OC(=O)CCn1cnc(n1)(N+)(=O)(O)
ZINC000002537013
ZINC2537013

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Available files

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