CAS 19811-05-3 | Methanone, (2,4-dichlorophenyl)phenyl- | CAS Number 19811-05-3

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19811-05-3 | Methanone, (2,4-dichlorophenyl)phenyl-

CAS No: 19811-05-3 Catalog No: AG002BB7 MDL No:MFCD00018374

Product Description

Catalog Number:

AG002BB7

Chemical Name:

Methanone, (2,4-dichlorophenyl)phenyl-

CAS Number:

19811-05-3

Molecular Formula:

C13H8Cl2O

Molecular Weight:

251.1080

MDL Number:

MFCD00018374

IUPAC Name:

(2,4-dichlorophenyl)-phenylmethanone

InChI:

InChI=1S/C13H8Cl2O/c14-10-6-7-11(12(15)8-10)13(16)9-4-2-1-3-5-9/h1-8H

InChI Key:

VLTYTTRXESKBKI-UHFFFAOYSA-N

SMILES:

Clc1ccc(c(c1)Cl)C(=O)c1ccccc1

EC Number:

243-338-6

Properties

Complexity:

248

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.995g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

251.106g/mol

Monoisotopic Mass:

249.995g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.5

Literature

Title	Journal
2,6-Bis(2,4-dimethyl-benzyl-idene)cyclo-hexa-none.	Acta crystallographica. Section E, Structure reports online 20100601
2,6-Bis(2,4-dichloro-benzyl-idene)cyclo-hexa-none.	Acta crystallographica. Section E, Structure reports online 20080801
Determination of organochlorine pesticides and their metabolites in radish after headspace solid-phase microextraction using calix[4]arene fiber.	Talanta 20050430