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Home > Pyridines > 652138-06-2
652138-06-2 | 4H-1-Benzopyran-4-one, 6-(2-benzofuranyl)-2-(4-pyridinyl)-
CAS No: 652138-06-2 Catalog No: AG00H6ZS MDL No:
Product Description
Catalog Number:
AG00H6ZS
Chemical Name:
4H-1-Benzopyran-4-one, 6-(2-benzofuranyl)-2-(4-pyridinyl)-
CAS Number:
652138-06-2
Molecular Formula:
C22H13NO3
Molecular Weight:
339.3435
IUPAC Name:
6-(1-benzofuran-2-yl)-2-pyridin-4-ylchromen-4-one
InChI:
InChI=1S/C22H13NO3/c24-18-13-22(14-7-9-23-10-8-14)26-20-6-5-16(11-17(18)20)21-12-15-3-1-2-4-19(15)25-21/h1-13H
InChI Key:
ZSCPFDKBEMLUGU-UHFFFAOYSA-N
SMILES:
O=c1cc(oc2c1cc(cc2)c1cc2c(o1)cccc2)c1ccncc1
Properties
Complexity:
568
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.09g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.35g/mol
Monoisotopic Mass:
339.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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