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90173-71-0 | 3H-Pyrrolo[3,4-b]quinolin-3-one, 1,2-dihydro-2,9-dimethyl-
CAS No: 90173-71-0 Catalog No: AG00H64P MDL No:
Product Description
Catalog Number:
AG00H64P
Chemical Name:
3H-Pyrrolo[3,4-b]quinolin-3-one, 1,2-dihydro-2,9-dimethyl-
CAS Number:
90173-71-0
Molecular Formula:
C13H12N2O
Molecular Weight:
212.2472
IUPAC Name:
2,9-dimethyl-1H-pyrrolo[3,4-b]quinolin-3-one
InChI:
InChI=1S/C13H12N2O/c1-8-9-5-3-4-6-11(9)14-12-10(8)7-15(2)13(12)16/h3-6H,7H2,1-2H3
InChI Key:
FBNLIYLNEKPITD-UHFFFAOYSA-N
SMILES:
CN1Cc2c(C1=O)nc1c(c2C)cccc1
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.252g/mol
Monoisotopic Mass:
212.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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