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844856-60-6 | 3-Bromo-3'-fluorobiphenyl
CAS No: 844856-60-6 Catalog No: AG01EXP9 MDL No:
Product Description
Catalog Number:
AG01EXP9
Chemical Name:
3-Bromo-3'-fluorobiphenyl
CAS Number:
844856-60-6
Molecular Formula:
C12H8BrF
Molecular Weight:
251.0943
IUPAC Name:
1-bromo-3-(3-fluorophenyl)benzene
InChI:
InChI=1S/C12H8BrF/c13-11-5-1-3-9(7-11)10-4-2-6-12(14)8-10/h1-8H
InChI Key:
MTJHDXYXFHYGTO-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)c1cccc(c1)Br
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.979g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.098g/mol
Monoisotopic Mass:
249.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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