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119264-60-7 | 1,1'-Biphenyl, 2,2',3,3',4,5',6,6'-octabromo-
CAS No: 119264-60-7 Catalog No: AG000IHB MDL No:
Product Description
Catalog Number:
AG000IHB
Chemical Name:
1,1'-Biphenyl, 2,2',3,3',4,5',6,6'-octabromo-
CAS Number:
119264-60-7
Molecular Formula:
C12H2Br8
Molecular Weight:
785.3763
IUPAC Name:
1,2,3,5-tetrabromo-4-(2,3,5,6-tetrabromophenyl)benzene
InChI:
InChI=1S/C12H2Br8/c13-3-1-6(16)11(19)12(20)7(3)8-9(17)4(14)2-5(15)10(8)18/h1-2H
InChI Key:
XWEDREXJLOGPJT-UHFFFAOYSA-N
SMILES:
Brc1cc(Br)c(c(c1Br)Br)c1c(Br)c(Br)cc(c1Br)Br
UNII:
5853DG0C6W
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
785.354g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
785.38g/mol
Monoisotopic Mass:
777.362g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.1
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