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951884-37-0 | 3,5-Dimethyl-4'-iodobenzophenone
CAS No: 951884-37-0 Catalog No: AG01EZLU MDL No:
Product Description
Catalog Number:
AG01EZLU
Chemical Name:
3,5-Dimethyl-4'-iodobenzophenone
CAS Number:
951884-37-0
Molecular Formula:
C15H13IO
Molecular Weight:
336.1676
IUPAC Name:
(3,5-dimethylphenyl)-(4-iodophenyl)methanone
InChI:
InChI=1S/C15H13IO/c1-10-7-11(2)9-13(8-10)15(17)12-3-5-14(16)6-4-12/h3-9H,1-2H3
InChI Key:
KOYYNYIOZGRLNB-UHFFFAOYSA-N
SMILES:
Ic1ccc(cc1)C(=O)c1cc(C)cc(c1)C
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.001g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.172g/mol
Monoisotopic Mass:
336.001g/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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