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Home > Pyridines > 1376227-04-1
1376227-04-1 | 2-methyl-2H,3H,5H,6H,7H,8H-pyrido[4,3-c]pyridazin-3-one hydrochloride
CAS No: 1376227-04-1 Catalog No: AG019U34 MDL No:MFCD22056331
Product Description
Catalog Number:
AG019U34
Chemical Name:
2-methyl-2H,3H,5H,6H,7H,8H-pyrido[4,3-c]pyridazin-3-one hydrochloride
CAS Number:
1376227-04-1
Molecular Formula:
C8H12ClN3O
Molecular Weight:
201.6534
MDL Number:
MFCD22056331
IUPAC Name:
2-methyl-5,6,7,8-tetrahydropyrido[4,3-c]pyridazin-3-one;hydrochloride
InChI:
InChI=1S/C8H11N3O.ClH/c1-11-8(12)4-6-5-9-3-2-7(6)10-11;/h4,9H,2-3,5H2,1H3;1H
InChI Key:
NLKSFJQABGMHEK-UHFFFAOYSA-N
SMILES:
Cn1nc2CCNCc2cc1=O.Cl
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.067g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
201.654g/mol
Monoisotopic Mass:
201.067g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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