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198345-21-0 | Ethanone, 2-(benzoyloxy)-2-(3,5-dimethoxyphenyl)-1-phenyl-
CAS No: 198345-21-0 Catalog No: AG002BGB MDL No:
Product Description
Catalog Number:
AG002BGB
Chemical Name:
Ethanone, 2-(benzoyloxy)-2-(3,5-dimethoxyphenyl)-1-phenyl-
CAS Number:
198345-21-0
Molecular Formula:
C23H20O5
Molecular Weight:
376.4019
IUPAC Name:
[1-(3,5-dimethoxyphenyl)-2-oxo-2-phenylethyl] benzoate
InChI:
InChI=1S/C23H20O5/c1-26-19-13-18(14-20(15-19)27-2)22(21(24)16-9-5-3-6-10-16)28-23(25)17-11-7-4-8-12-17/h3-15,22H,1-2H3
InChI Key:
BXBOCEGOLXWSEF-UHFFFAOYSA-N
SMILES:
COc1cc(OC)cc(c1)C(C(=O)c1ccccc1)OC(=O)c1ccccc1
Properties
Complexity:
495
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.131g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
376.408g/mol
Monoisotopic Mass:
376.131g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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