Vitas-M small molecule compound

4-(1,3-benzodioxol-5-yloxy)butanoic acid

Catalog ID
STK317889
SMILES OC(=O)CCCOc1ccc2c(c1)OCO2

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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 C11H12O5 MW 224.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12O5/c12-11(13)2-1-5-14-8-3-4-9-10(6-8)16-7-15-9/h3-4,6H,1-2,5,7H2,(H,12,13)
InChIKey
TUKIMVAQBCKDGS-UHFFFAOYSA-N
Synonyms
127556-98-3
127556983
4(13benzodioxol5yloxy)butanoicacid
4(2H13BENZODIOXOL5YLOXY)BUTANOICACID
4(2HBENZO(34D)13DIOXOLEN5YLOXY)BUTANOICACID
4(BENZO(13)DIOXOL5YLOXY)BUTYRICACID
C1OC2=C(O1)C=C(C=C2)OCCCC(=O)O
InChI=1SC11H12O5c1211(13)21514834910(68)167159h346H1257H2(H1213)
MFCD07403058
ZINC000004988443
ZINC4988443

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Available files

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