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1365565-32-7 | 4H-Pyran-4-one, 2,3-dihydro-2-(1,2,2-triphenylethenyl)-
CAS No: 1365565-32-7 Catalog No: AG001227 MDL No:
Product Description
Catalog Number:
AG001227
Chemical Name:
4H-Pyran-4-one, 2,3-dihydro-2-(1,2,2-triphenylethenyl)-
CAS Number:
1365565-32-7
Molecular Formula:
C25H20O2
Molecular Weight:
352.4251
IUPAC Name:
2-(1,2,2-triphenylethenyl)-2,3-dihydropyran-4-one
InChI:
InChI=1S/C25H20O2/c26-22-16-17-27-23(18-22)25(21-14-8-3-9-15-21)24(19-10-4-1-5-11-19)20-12-6-2-7-13-20/h1-17,23H,18H2
InChI Key:
WEGCLBIQMZNOCY-UHFFFAOYSA-N
SMILES:
O=C1C=COC(C1)C(=C(c1ccccc1)c1ccccc1)c1ccccc1
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.146g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.433g/mol
Monoisotopic Mass:
352.146g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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