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25186-99-6 | Methanone, bis(3-iodophenyl)-
CAS No: 25186-99-6 Catalog No: AG002QT3 MDL No:MFCD00227471
Product Description
Catalog Number:
AG002QT3
Chemical Name:
Methanone, bis(3-iodophenyl)-
CAS Number:
25186-99-6
Molecular Formula:
C13H8I2O
Molecular Weight:
434.0110
MDL Number:
MFCD00227471
IUPAC Name:
bis(3-iodophenyl)methanone
InChI:
InChI=1S/C13H8I2O/c14-11-5-1-3-9(7-11)13(16)10-4-2-6-12(15)8-10/h1-8H
InChI Key:
NKUNBQOGOCFLNG-UHFFFAOYSA-N
SMILES:
Ic1cccc(c1)C(=O)c1cccc(c1)I
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
433.866g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
434.015g/mol
Monoisotopic Mass:
433.866g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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