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Home > Pyridines > 953423-73-9
953423-73-9 | 3-(pyridine-2-carbonyl)-1-benzofuran-5-ol
CAS No: 953423-73-9 Catalog No: AG00VX4J MDL No:
Product Description
Catalog Number:
AG00VX4J
Chemical Name:
3-(pyridine-2-carbonyl)-1-benzofuran-5-ol
CAS Number:
953423-73-9
Molecular Formula:
C14H9NO3
Molecular Weight:
239.2262
IUPAC Name:
(5-hydroxy-1-benzofuran-3-yl)-pyridin-2-ylmethanone
InChI:
InChI=1S/C14H9NO3/c16-9-4-5-13-10(7-9)11(8-18-13)14(17)12-3-1-2-6-15-12/h1-8,16H
InChI Key:
RGOCAKAKTJSDFR-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)c(co2)C(=O)c1ccccn1
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.058g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.23g/mol
Monoisotopic Mass:
239.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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