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1012068-73-3 | 9-methyl-1H,2H,3H-pyrrolo[3,4-b]quinolin-1-one
CAS No: 1012068-73-3 Catalog No: AG019MN9 MDL No:MFCD11099414
Product Description
Catalog Number:
AG019MN9
Chemical Name:
9-methyl-1H,2H,3H-pyrrolo[3,4-b]quinolin-1-one
CAS Number:
1012068-73-3
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
MDL Number:
MFCD11099414
IUPAC Name:
9-methyl-2,3-dihydropyrrolo[3,4-b]quinolin-1-one
InChI:
InChI=1S/C12H10N2O/c1-7-8-4-2-3-5-9(8)14-10-6-13-12(15)11(7)10/h2-5H,6H2,1H3,(H,13,15)
InChI Key:
GNFFCOIZNPHSDE-UHFFFAOYSA-N
SMILES:
O=C1NCc2c1c(C)c1c(n2)cccc1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.225g/mol
Monoisotopic Mass:
198.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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