2,6-Dibromoiodobenzene

CAT: 0127-OR55629-01Size: 1 gDry Ice: NoHazardous: No

1 / 1

CAT#:0127-OR55629-01Size:1 g

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

19821-80-8

MDL Number

MFCD00192666

Purity

=95%

Smiles

Brc1cccc(Br)c1I

Chemical Information

1,3-Dibromo-2-iodo-benzene

CAS Number	19821-80-8
PubChem CID	4403794
IUPAC Name	1,3-dibromo-2-iodobenzene
Molecular Formula	C6H3Br2I
Molecular Weight	361.80
XLogP	4
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Heavy Atom Count	9
Formal Charge	0
Complexity	87

SMILES

C1=CC(=C(C(=C1)Br)I)Br

InChI

InChI=1S/C6H3Br2I/c7-4-2-1-3-5(8)6(4)9/h1-3H

InChIKey

OIFRMZVTJQAPIF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 19821-80-8

CID: 4403794

Formula: C6H3Br2I

MW: 361.80

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	361.80
XLogP3	4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	361.76257
Monoisotopic Mass	359.76462
Topological Polar Surface Area	0 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	87.1
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR471033-01	2,4-Dibromoiodobenzene
OR1062063-01	[2,2':6',2''-Terpyridine]-6,6''-dicarbonitrile
OR1026256-01	6,6''-Dibromo-2,2':6',2''-Terpyridine
OR1074306-01	2,2':6',2'':6'',2'''-Quaterpyridine
OR30412-01	2,2,6,6-Tetramethylpiperidine
OR73611-01	2,2,6,6-Tetramethylmorpholine
OR1072848-01	[2,2':6',2''-Terpyridine]-6,6''-dicarboxylic acid
OR310638-01	2,2,6,6-Tetramethylpimelic acid
OR480659-01	2,2,6,6-Tetrachloro-cyclohexanone
OR950887-01	6,6'-Dihydroxy-2,2'-bipyridyl