CAS 16331-52-5 | 9-ANTHRACENECARBONYL CHLORIDE | CAS Number 16331-52-5

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16331-52-5 | 9-ANTHRACENECARBONYL CHLORIDE

CAS No: 16331-52-5 Catalog No: AG001U10 MDL No:

Product Description

Catalog Number:

AG001U10

Chemical Name:

9-ANTHRACENECARBONYL CHLORIDE

CAS Number:

16331-52-5

Molecular Formula:

C15H9ClO

Molecular Weight:

240.6844

IUPAC Name:

anthracene-9-carbonyl chloride

InChI:

InChI=1S/C15H9ClO/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9H

InChI Key:

REJFOBQJXSGDSB-UHFFFAOYSA-N

SMILES:

ClC(=O)c1c2ccccc2cc2c1cccc2

Properties

Complexity:

279

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.034g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

240.686g/mol

Monoisotopic Mass:

240.034g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.8

Literature

Title	Journal
Synthesis of heteroleptic anthryl-substituted beta-ketoenolates of rhodium(III) and iridium(III): photophysical, electrochemical, and EPR study of the fluorophore-metal interaction.	Inorganic chemistry 20020701
A [4 pi+4 pi] intramolecular photocyclomer of 9-anthroic anhydride: 5,6,11,12-tetrahydro-5,12;6,11-di-o-benzenodibenzo[a,e]cyclooctene-5,6-dicarboxylic anhydride.	Acta crystallographica. Section C, Crystal structure communications 20020601