Vitas-M small molecule compound

1-O-[(2-chlorophenyl)carbonyl]hexitol

Catalog ID
STL548271
SMILES OCC(C(C(C(COC(=O)c1ccccc1Cl)O)O)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 C13H17ClO7 MW 320.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17ClO7/c14-8-4-2-1-3-7(8)13(20)21-6-10(17)12(19)11(18)9(16)5-15/h1-4,9-12,15-19H,5-6H2
InChIKey
GQGUIKOVSYGALC-UHFFFAOYSA-N
Synonyms

1O((2chlorophenyl)carbonyl)hexitol
23456pentahydroxyhexyl2chlorobenzoate
5135236
InChI=1SC13H17ClO7c14842137(8)13(20)21610(17)12(19)11(18)9(16)515h149121519H56H2
MFCD01084070
ZINC000004064369
ZINC000012861505

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Available files

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