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681828-20-6 | 4(1H)-Quinolinone, 1-benzoyl-2,3-dihydro-2-methyl-
CAS No: 681828-20-6 Catalog No: AG005YM2 MDL No:
Product Description
Catalog Number:
AG005YM2
Chemical Name:
4(1H)-Quinolinone, 1-benzoyl-2,3-dihydro-2-methyl-
CAS Number:
681828-20-6
Molecular Formula:
C17H15NO2
Molecular Weight:
265.3065
IUPAC Name:
1-benzoyl-2-methyl-2,3-dihydroquinolin-4-one
InChI:
InChI=1S/C17H15NO2/c1-12-11-16(19)14-9-5-6-10-15(14)18(12)17(20)13-7-3-2-4-8-13/h2-10,12H,11H2,1H3
InChI Key:
QEFXWQPMGCAJAH-UHFFFAOYSA-N
SMILES:
CC1CC(=O)c2c(N1C(=O)c1ccccc1)cccc2
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.11g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.312g/mol
Monoisotopic Mass:
265.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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