Vitas-M small molecule compound

1-(3-chloroazulen-1-yl)ethanone

Catalog ID
STK368448
SMILES CC(=O)c1cc(c2c1ccccc2)Cl

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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 C12H9ClO MW 204.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9ClO/c1-8(14)11-7-12(13)10-6-4-2-3-5-9(10)11/h2-7H,1H3
InChIKey
SZVCRUNREXCJAD-UHFFFAOYSA-N
Synonyms
91498-68-9
1(3chloroazulen1yl)ethanone
91498689
CC(=O)C1=CC(=C2C1=CC=CC=C2)Cl
InChI=1SC12H9ClOc18(14)11712(13)10642359(10)11h27H1H3
MFCD00460800
ZINC000003164291
ZINC03164291
ZINC3164291

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Available files

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