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116831-33-5 | 1,1'-Biphenyl, 4-bromo-2-fluoro-4'-propyl-
CAS No: 116831-33-5 Catalog No: AG000DAE MDL No:
Product Description
Catalog Number:
AG000DAE
Chemical Name:
1,1'-Biphenyl, 4-bromo-2-fluoro-4'-propyl-
CAS Number:
116831-33-5
Molecular Formula:
C15H14BrF
Molecular Weight:
293.1741
IUPAC Name:
4-bromo-2-fluoro-1-(4-propylphenyl)benzene
InChI:
InChI=1S/C15H14BrF/c1-2-3-11-4-6-12(7-5-11)14-9-8-13(16)10-15(14)17/h4-10H,2-3H2,1H3
InChI Key:
DNXBMIIAWYFUQJ-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)c1ccc(cc1F)Br
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.026g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.179g/mol
Monoisotopic Mass:
292.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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