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57186-90-0 | 1-Bromo-3-(4-bromophenyl)benzene
CAS No: 57186-90-0 Catalog No: AG003E3O MDL No:
Product Description
Catalog Number:
AG003E3O
Chemical Name:
1-Bromo-3-(4-bromophenyl)benzene
CAS Number:
57186-90-0
Molecular Formula:
C12H8Br2
Molecular Weight:
311.9999
IUPAC Name:
1-bromo-3-(4-bromophenyl)benzene
InChI:
InChI=1S/C12H8Br2/c13-11-6-4-9(5-7-11)10-2-1-3-12(14)8-10/h1-8H
InChI Key:
DLAKCVTXQRIHEY-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1cccc(c1)Br
UNII:
A1ID8D8XLH
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.897g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.004g/mol
Monoisotopic Mass:
309.899g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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