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89449-74-1 | Methanone, (3,6-dimethoxy-1,2-phenylene)bis[phenyl-
CAS No: 89449-74-1 Catalog No: AG0044EI MDL No:
Product Description
Catalog Number:
AG0044EI
Chemical Name:
Methanone, (3,6-dimethoxy-1,2-phenylene)bis[phenyl-
CAS Number:
89449-74-1
Molecular Formula:
C22H18O4
Molecular Weight:
346.3759
IUPAC Name:
(2-benzoyl-3,6-dimethoxyphenyl)-phenylmethanone
InChI:
InChI=1S/C22H18O4/c1-25-17-13-14-18(26-2)20(22(24)16-11-7-4-8-12-16)19(17)21(23)15-9-5-3-6-10-15/h3-14H,1-2H3
InChI Key:
ODNXJRGLDXUPHQ-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1C(=O)c1ccccc1)C(=O)c1ccccc1)OC
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.121g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
346.382g/mol
Monoisotopic Mass:
346.121g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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