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951891-92-2 | 3,4-Dimethoxy-3'-iodobenzophenone
CAS No: 951891-92-2 Catalog No: AG01EZZE MDL No:
Product Description
Catalog Number:
AG01EZZE
Chemical Name:
3,4-Dimethoxy-3'-iodobenzophenone
CAS Number:
951891-92-2
Molecular Formula:
C15H13IO3
Molecular Weight:
368.1664
IUPAC Name:
(3,4-dimethoxyphenyl)-(3-iodophenyl)methanone
InChI:
InChI=1S/C15H13IO3/c1-18-13-7-6-11(9-14(13)19-2)15(17)10-4-3-5-12(16)8-10/h3-9H,1-2H3
InChI Key:
JMSBROOMAKIXCG-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1OC)C(=O)c1cccc(c1)I
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.991g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.17g/mol
Monoisotopic Mass:
367.991g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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