Vitas-M small molecule compound

(2E)-3-(4-butoxy-3-methoxyphenyl)prop-2-enoic acid

Catalog ID
STL510563
SMILES CCCCOc1ccc(cc1OC)/C=C/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 C14H18O4 MW 250.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18O4/c1-3-4-9-18-12-7-5-11(6-8-14(15)16)10-13(12)17-2/h5-8,10H,3-4,9H2,1-2H3,(H,15,16)/b8-6+
InChIKey
PLGNEGWMEJBADZ-SOFGYWHQSA-N
Synonyms
92864-98-7
(~(E))3(4butoxy3methoxyphenyl)prop2enoicacid
(2E)3(4BUTOXY3METHOXYPHENYL)2PROPENOICACID
(2E)3(4BUTOXY3METHOXYPHENYL)ACRYLICACID
(2E)3(4butoxy3methoxyphenyl)prop2enoicacid
(E)3(4BUTOXY3METHOXYPHENYL)PROP2ENOICACID
(E)4BUTOXY3METHOXYCINNAMICACID
(E)4BUTYLOXY3METHOXYCINNAMICACID
3(4BUTOXY3METHOXYPHENYL)PROP2ENOICACID
5933564
92864987
InChI=1SC14H18O4c134918127511(6814(15)16)1013(12)172h5810H349H212H3(H1516)b86+
MFCD02256113
ZINC000001842852
ZINC1842852

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Available files

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