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205448-29-9 | 4(1H)-Quinolinone, 6-methoxy-7-(phenylmethoxy)-
CAS No: 205448-29-9 Catalog No: AG002A2Y MDL No:
Product Description
Catalog Number:
AG002A2Y
Chemical Name:
4(1H)-Quinolinone, 6-methoxy-7-(phenylmethoxy)-
CAS Number:
205448-29-9
Molecular Formula:
C17H15NO3
Molecular Weight:
281.3059
IUPAC Name:
6-methoxy-7-phenylmethoxy-1H-quinolin-4-one
InChI:
InChI=1S/C17H15NO3/c1-20-16-9-13-14(18-8-7-15(13)19)10-17(16)21-11-12-5-3-2-4-6-12/h2-10H,11H2,1H3,(H,18,19)
InChI Key:
OXRDTRDGXMHOOV-UHFFFAOYSA-N
SMILES:
COc1cc2c(cc1OCc1ccccc1)[nH]ccc2=O
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.105g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.311g/mol
Monoisotopic Mass:
281.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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