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Home > Fluorides > 137489-13-5
137489-13-5 | 1,1'-Biphenyl, 4-[2-(4-ethoxyphenyl)ethyl]-2,4',6-trifluoro-
CAS No: 137489-13-5 Catalog No: AG0013CQ MDL No:
Product Description
Catalog Number:
AG0013CQ
Chemical Name:
1,1'-Biphenyl, 4-[2-(4-ethoxyphenyl)ethyl]-2,4',6-trifluoro-
CAS Number:
137489-13-5
Molecular Formula:
C22H19F3O
Molecular Weight:
356.3809
IUPAC Name:
5-[2-(4-ethoxyphenyl)ethyl]-1,3-difluoro-2-(4-fluorophenyl)benzene
InChI:
InChI=1S/C22H19F3O/c1-2-26-19-11-5-15(6-12-19)3-4-16-13-20(24)22(21(25)14-16)17-7-9-18(23)10-8-17/h5-14H,2-4H2,1H3
InChI Key:
QHCUCZODUOLGKI-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)CCc1cc(F)c(c(c1)F)c1ccc(cc1)F
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.139g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
356.388g/mol
Monoisotopic Mass:
356.139g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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