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821004-10-8 | 4(1H)-Quinolinone, 3-(2-naphthalenylcarbonyl)-
CAS No: 821004-10-8 Catalog No: AG005AW5 MDL No:
Product Description
Catalog Number:
AG005AW5
Chemical Name:
4(1H)-Quinolinone, 3-(2-naphthalenylcarbonyl)-
CAS Number:
821004-10-8
Molecular Formula:
C20H13NO2
Molecular Weight:
299.3227
IUPAC Name:
3-(naphthalene-2-carbonyl)-1H-quinolin-4-one
InChI:
InChI=1S/C20H13NO2/c22-19(15-10-9-13-5-1-2-6-14(13)11-15)17-12-21-18-8-4-3-7-16(18)20(17)23/h1-12H,(H,21,23)
InChI Key:
MQJXYXBBQAYJAD-UHFFFAOYSA-N
SMILES:
O=C(c1c[nH]c2c(c1=O)cccc2)c1ccc2c(c1)cccc2
Properties
Complexity:
524
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.095g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
299.329g/mol
Monoisotopic Mass:
299.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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