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65699-84-5 | Ethanedione, bis(4-iodophenyl)-
CAS No: 65699-84-5 Catalog No: AG006PP0 MDL No:
Product Description
Catalog Number:
AG006PP0
Chemical Name:
Ethanedione, bis(4-iodophenyl)-
CAS Number:
65699-84-5
Molecular Formula:
C14H8I2O2
Molecular Weight:
462.0211
IUPAC Name:
1,2-bis(4-iodophenyl)ethane-1,2-dione
InChI:
InChI=1S/C14H8I2O2/c15-11-5-1-9(2-6-11)13(17)14(18)10-3-7-12(16)8-4-10/h1-8H
InChI Key:
PYWIIQJCCHOQSM-UHFFFAOYSA-N
SMILES:
O=C(C(=O)c1ccc(cc1)I)c1ccc(cc1)I
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
461.861g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
462.025g/mol
Monoisotopic Mass:
461.861g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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