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Home > Pyridines > 116060-93-6
116060-93-6 | Furo[3,4-b]pyridin-5(7H)-one, 7-hydroxy-7-phenyl-
CAS No: 116060-93-6 Catalog No: AG000BIN MDL No:
Product Description
Catalog Number:
AG000BIN
Chemical Name:
Furo[3,4-b]pyridin-5(7H)-one, 7-hydroxy-7-phenyl-
CAS Number:
116060-93-6
Molecular Formula:
C13H9NO3
Molecular Weight:
227.2155
IUPAC Name:
7-hydroxy-7-phenylfuro[3,4-b]pyridin-5-one
InChI:
InChI=1S/C13H9NO3/c15-12-10-7-4-8-14-11(10)13(16,17-12)9-5-2-1-3-6-9/h1-8,16H
InChI Key:
KDDUDLAYGQZGOG-UHFFFAOYSA-N
SMILES:
O=C1OC(c2c1cccn2)(O)c1ccccc1
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.058g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.219g/mol
Monoisotopic Mass:
227.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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