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Home > Pyridines > 1440519-80-1
1440519-80-1 | 5H-Pyrrolo[3,4-b]pyridin-5-one, 6,7-dihydro-2-methoxy-7,7-dimethyl-
CAS No: 1440519-80-1 Catalog No: AG001IU6 MDL No:MFCD26406955
Product Description
Catalog Number:
AG001IU6
Chemical Name:
5H-Pyrrolo[3,4-b]pyridin-5-one, 6,7-dihydro-2-methoxy-7,7-dimethyl-
CAS Number:
1440519-80-1
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
MDL Number:
MFCD26406955
IUPAC Name:
2-methoxy-7,7-dimethyl-6H-pyrrolo[3,4-b]pyridin-5-one
InChI:
InChI=1S/C10H12N2O2/c1-10(2)8-6(9(13)12-10)4-5-7(11-8)14-3/h4-5H,1-3H3,(H,12,13)
InChI Key:
PZWRYLXDGPTZTO-UHFFFAOYSA-N
SMILES:
COc1ccc2c(n1)C(C)(C)NC2=O
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.218g/mol
Monoisotopic Mass:
192.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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