CAS 18282-59-2 | Benzene, 4-bromo-1,2-dichloro- | CAS Number 18282-59-2

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18282-59-2 | Benzene, 4-bromo-1,2-dichloro-

CAS No: 18282-59-2 Catalog No: AG002468 MDL No:MFCD00040849

Product Description

Catalog Number:

AG002468

Chemical Name:

Benzene, 4-bromo-1,2-dichloro-

CAS Number:

18282-59-2

Molecular Formula:

C6H3BrCl2

Molecular Weight:

225.8980

MDL Number:

MFCD00040849

IUPAC Name:

4-bromo-1,2-dichlorobenzene

InChI:

InChI=1S/C6H3BrCl2/c7-4-1-2-5(8)6(9)3-4/h1-3H

InChI Key:

CFPZDVAZISWERM-UHFFFAOYSA-N

SMILES:

Brc1ccc(c(c1)Cl)Cl

EC Number:

242-160-6

Properties

Complexity:

97.1

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

223.88g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.894g/mol

Monoisotopic Mass:

223.88g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.1

Literature

Title	Journal
In vivo biotransformation of 3,3',4,4'-tetrachlorobiphenyl by whole plants-poplars and switchgrass.	Environmental science & technology 20091001
Bis[4-(dimethyl-amino)pyridinium] tetra-bromidobis(3,4-dichloro-phen-yl)stannate(IV)-1-bromo-3,4-dichloro-benzene (1/1).	Acta crystallographica. Section E, Structure reports online 20090601