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Home > Pyridines > 1391732-96-9
1391732-96-9 | 3-Hydroxy-6,7-dimethyl-6,7-dihydro-pyrrolo[3,4-b]pyridin-5-one
CAS No: 1391732-96-9 Catalog No: AG00HVFF MDL No:MFCD23378491
Product Description
Catalog Number:
AG00HVFF
Chemical Name:
3-Hydroxy-6,7-dimethyl-6,7-dihydro-pyrrolo[3,4-b]pyridin-5-one
CAS Number:
1391732-96-9
Molecular Formula:
C9H10N2O2
Molecular Weight:
178.1879
MDL Number:
MFCD23378491
IUPAC Name:
3-hydroxy-6,7-dimethyl-7H-pyrrolo[3,4-b]pyridin-5-one
InChI:
InChI=1S/C9H10N2O2/c1-5-8-7(9(13)11(5)2)3-6(12)4-10-8/h3-5,12H,1-2H3
InChI Key:
XRCSACKTFYXDGY-UHFFFAOYSA-N
SMILES:
Oc1cnc2c(c1)C(=O)N(C2C)C
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.074g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.191g/mol
Monoisotopic Mass:
178.074g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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