Vitas-M small molecule compound

(2E)-3-{2-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}prop-2-enoic acid

Catalog ID
STL510531
SMILES COc1cccc(c1OCc1ccc(cc1)Cl)/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 C17H15ClO4 MW 318.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClO4/c1-21-15-4-2-3-13(7-10-16(19)20)17(15)22-11-12-5-8-14(18)9-6-12/h2-10H,11H2,1H3,(H,19,20)/b10-7+
InChIKey
BCIJYKCJLMKEPP-JXMROGBWSA-N
Synonyms

(~(E))3(2((4chlorophenyl)methoxy)3methoxyphenyl)prop2enoicacid
(2E)3(2((4chlorobenzyl)oxy)3methoxyphenyl)prop2enoicacid
42199766
InChI=1SC17H15ClO4c1211542313(71016(19)20)17(15)2211125814(18)9612h210H11H21H3(H1920)b107+
MFCD31711512
ZINC000011822297
ZINC11822297

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Available files

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