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88241-90-1 | 1,1':2',1'':3'',1''':2''',1''''-Quinquephenyl, 5''-iodo-
CAS No: 88241-90-1 Catalog No: AG008B0O MDL No:
Product Description
Catalog Number:
AG008B0O
Chemical Name:
1,1':2',1'':3'',1''':2''',1''''-Quinquephenyl, 5''-iodo-
CAS Number:
88241-90-1
Molecular Formula:
C30H21I
Molecular Weight:
508.3922
IUPAC Name:
1-iodo-3,5-bis(2-phenylphenyl)benzene
InChI:
InChI=1S/C30H21I/c31-26-20-24(29-17-9-7-15-27(29)22-11-3-1-4-12-22)19-25(21-26)30-18-10-8-16-28(30)23-13-5-2-6-14-23/h1-21H
InChI Key:
AQJOGNYUYGTSAR-UHFFFAOYSA-N
SMILES:
Ic1cc(cc(c1)c1ccccc1c1ccccc1)c1ccccc1c1ccccc1
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
508.069g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
508.402g/mol
Monoisotopic Mass:
508.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.9
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