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951887-45-9 | 4-Iodo-4'-methylbenzophenone
CAS No: 951887-45-9 Catalog No: AG01EZQK MDL No:
Product Description
Catalog Number:
AG01EZQK
Chemical Name:
4-Iodo-4'-methylbenzophenone
CAS Number:
951887-45-9
Molecular Formula:
C14H11IO
Molecular Weight:
322.1410
IUPAC Name:
(4-iodophenyl)-(4-methylphenyl)methanone
InChI:
InChI=1S/C14H11IO/c1-10-2-4-11(5-3-10)14(16)12-6-8-13(15)9-7-12/h2-9H,1H3
InChI Key:
PLVOIHKMHMFYMR-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)c1ccc(cc1)I
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.985g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.145g/mol
Monoisotopic Mass:
321.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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