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80254-71-3 | 3-Fluoro-3'-methyl-1,1'-biphenyl
CAS No: 80254-71-3 Catalog No: AG01EXH5 MDL No:
Product Description
Catalog Number:
AG01EXH5
Chemical Name:
3-Fluoro-3'-methyl-1,1'-biphenyl
CAS Number:
80254-71-3
Molecular Formula:
C13H11F
Molecular Weight:
186.2248
IUPAC Name:
1-fluoro-3-(3-methylphenyl)benzene
InChI:
InChI=1S/C13H11F/c1-10-4-2-5-11(8-10)12-6-3-7-13(14)9-12/h2-9H,1H3
InChI Key:
SNPGMCLEHULHFI-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)c1cccc(c1)F
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.229g/mol
Monoisotopic Mass:
186.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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