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227450-80-8 | 4(1H)-Quinolinone, 7-hydroxy-3-(4-methoxyphenyl)-
CAS No: 227450-80-8 Catalog No: AG006WNG MDL No:
Product Description
Catalog Number:
AG006WNG
Chemical Name:
4(1H)-Quinolinone, 7-hydroxy-3-(4-methoxyphenyl)-
CAS Number:
227450-80-8
Molecular Formula:
C16H13NO3
Molecular Weight:
267.2793
IUPAC Name:
7-hydroxy-3-(4-methoxyphenyl)-1H-quinolin-4-one
InChI:
InChI=1S/C16H13NO3/c1-20-12-5-2-10(3-6-12)14-9-17-15-8-11(18)4-7-13(15)16(14)19/h2-9,18H,1H3,(H,17,19)
InChI Key:
PZTOSBOUOUYKDL-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1c[nH]c2c(c1=O)ccc(c2)O
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
267.284g/mol
Monoisotopic Mass:
267.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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