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96843-21-9 | 2',5'-Diiodo-p-terphenyl
CAS No: 96843-21-9 Catalog No: AG006661 MDL No:
Product Description
Catalog Number:
AG006661
Chemical Name:
2',5'-Diiodo-p-terphenyl
CAS Number:
96843-21-9
Molecular Formula:
C18H12I2
Molecular Weight:
482.0968
IUPAC Name:
1,4-diiodo-2,5-diphenylbenzene
InChI:
InChI=1S/C18H12I2/c19-17-12-16(14-9-5-2-6-10-14)18(20)11-15(17)13-7-3-1-4-8-13/h1-12H
InChI Key:
DBWNLYZBUNSDRL-UHFFFAOYSA-N
SMILES:
Ic1cc(c(cc1c1ccccc1)I)c1ccccc1
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
481.903g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
482.103g/mol
Monoisotopic Mass:
481.903g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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