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876009-96-0 | 3-FLUORO-2,2',5,5'-TETRACHLOROBIPHENYL
CAS No: 876009-96-0 Catalog No: AG004LZG MDL No:
Product Description
Catalog Number:
AG004LZG
Chemical Name:
3-FLUORO-2,2',5,5'-TETRACHLOROBIPHENYL
CAS Number:
876009-96-0
Molecular Formula:
C12H5Cl4F
Molecular Weight:
309.9785
IUPAC Name:
2,5-dichloro-1-(2,5-dichlorophenyl)-3-fluorobenzene
InChI:
InChI=1S/C12H5Cl4F/c13-6-1-2-10(15)8(3-6)9-4-7(14)5-11(17)12(9)16/h1-5H
InChI Key:
ZZLRHBCOASRJTC-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)c1cc(Cl)cc(c1Cl)F)Cl
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.91g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.97g/mol
Monoisotopic Mass:
307.913g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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