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Home > Fluorides > 820233-86-1
820233-86-1 | Benz[g]isoquinoline, 1,4-bis(4-fluorophenyl)-3-phenyl-
CAS No: 820233-86-1 Catalog No: AG0053EA MDL No:
Product Description
Catalog Number:
AG0053EA
Chemical Name:
Benz[g]isoquinoline, 1,4-bis(4-fluorophenyl)-3-phenyl-
CAS Number:
820233-86-1
Molecular Formula:
C31H19F2N
Molecular Weight:
443.4861
IUPAC Name:
1,4-bis(4-fluorophenyl)-3-phenylbenzo[g]isoquinoline
InChI:
InChI=1S/C31H19F2N/c32-25-14-10-20(11-15-25)29-27-18-23-8-4-5-9-24(23)19-28(27)30(22-12-16-26(33)17-13-22)34-31(29)21-6-2-1-3-7-21/h1-19H
InChI Key:
TWEVFFIRVUVWQM-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1nc(c2ccccc2)c(c2c1cc1ccccc1c2)c1ccc(cc1)F
Properties
Complexity:
646
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
443.149g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
443.497g/mol
Monoisotopic Mass:
443.149g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.2
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