Vitas-M small molecule compound

2-(methoxycarbonyl)phenyl 3-iodo-4-methoxybenzoate

Catalog ID
STL064071
SMILES COC(=O)c1ccccc1OC(=O)c1ccc(c(c1)I)OC

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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 C16H13IO5 MW 412.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13IO5/c1-20-14-8-7-10(9-12(14)17)15(18)22-13-6-4-3-5-11(13)16(19)21-2/h3-9H,1-2H3
InChIKey
OBQKDPYFRYTVDQ-UHFFFAOYSA-N
Synonyms

(2METHOXYCARBONYLPHENYL)3IODO4METHOXYBENZOATE
2(methoxycarbonyl)phenyl3iodo4methoxybenzoate
COC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2C(=O)OC)I
InChI=1SC16H13IO5c120148710(912(14)17)15(18)2213643511(13)16(19)212h39H12H3
MFCD05054077
ZINC000002887896
ZINC02887896
ZINC2887896

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Available files

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