Vitas-M small molecule compound

4-(5-methyl-2-oxo-1,3-benzoxazol-3(2H)-yl)butanoic acid

Catalog ID
STK317921
SMILES OC(=O)CCCn1c(=O)oc2c1cc(C)cc2

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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 C12H13NO4 MW 235.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO4/c1-8-4-5-10-9(7-8)13(12(16)17-10)6-2-3-11(14)15/h4-5,7H,2-3,6H2,1H3,(H,14,15)
InChIKey
DMCYPLWZIAPHLA-UHFFFAOYSA-N
Synonyms
878046-68-5
4(5methyl2oxo13benzoxazol3(2H)yl)butanoicacid
4(5METHYL2OXO13BENZOXAZOL3YL)BUTANOICACID
4(5METHYL2OXO3HYDROBENZOXAZOL3YL)BUTANOICACID
4(5METHYL2OXOBENZOOXAZOL3YL)BUTYRICACID
878046685
CC1=CC2=C(C=C1)OC(=O)N2CCCC(=O)O
InChI=1SC12H13NO4c1845109(78)13(12(16)1710)62311(14)15h457H236H21H3(H1415)
MFCD08056097
ZINC000006679779
ZINC6679779

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Available files

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