Vitas-M small molecule compound

2-(5-chloro-1H-1,2,4-triazol-1-yl)butanoic acid

Catalog ID
STL415409
SMILES CCC(n1ncnc1Cl)C(=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 C6H8ClN3O2 MW 189.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H8ClN3O2/c1-2-4(5(11)12)10-6(7)8-3-9-10/h3-4H,2H2,1H3,(H,11,12)
InChIKey
DCLSNINBWBKJAX-UHFFFAOYSA-N
Synonyms
1795480-08-8
1795480088
2(5chloro124triazol1yl)butanoicacid
2(5chloro1H124triazol1yl)butanoicacid
CCC(C(=O)O)N1C(=NC=N1)Cl
InChI=1SC6H8ClN3O2c124(5(11)12)106(7)83910h34H2H21H3(H1112)
MFCD28962861
ZINC000223250322
ZINC000223250368

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Available files

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