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102596-09-8 | 4H-1-Benzopyran-4-one, 7-(acetyloxy)-2,3-diphenyl-
CAS No: 102596-09-8 Catalog No: AG0007V0 MDL No:
Product Description
Catalog Number:
AG0007V0
Chemical Name:
4H-1-Benzopyran-4-one, 7-(acetyloxy)-2,3-diphenyl-
CAS Number:
102596-09-8
Molecular Formula:
C23H16O4
Molecular Weight:
356.3707
IUPAC Name:
(4-oxo-2,3-diphenylchromen-7-yl) acetate
InChI:
InChI=1S/C23H16O4/c1-15(24)26-18-12-13-19-20(14-18)27-23(17-10-6-3-7-11-17)21(22(19)25)16-8-4-2-5-9-16/h2-14H,1H3
InChI Key:
SKRXUSRYIPPVPB-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccccc1)c1ccccc1
Properties
Complexity:
596
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.105g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
356.377g/mol
Monoisotopic Mass:
356.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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