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852139-02-7 | 2,2'-Dibromo-5,5'-diiodo-1,1'-biphenyl
CAS No: 852139-02-7 Catalog No: AG004QB3 MDL No:
Product Description
Catalog Number:
AG004QB3
Chemical Name:
2,2'-Dibromo-5,5'-diiodo-1,1'-biphenyl
CAS Number:
852139-02-7
Molecular Formula:
C12H6Br2I2
Molecular Weight:
563.7930
IUPAC Name:
1-bromo-2-(2-bromo-5-iodophenyl)-4-iodobenzene
InChI:
InChI=1S/C12H6Br2I2/c13-11-3-1-7(15)5-9(11)10-6-8(16)2-4-12(10)14/h1-6H
InChI Key:
SXVVPRKANYYBOS-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1c1cc(I)ccc1Br)I
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
563.691g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
563.797g/mol
Monoisotopic Mass:
561.693g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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