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50369-66-9 | 9aH-Pyrido[1,2-a]pyrazine-9a-carbonitrile,octahydro-1-oxo-(9CI)
CAS No: 50369-66-9 Catalog No: AG00DMPF MDL No:
Product Description
Catalog Number:
AG00DMPF
Chemical Name:
9aH-Pyrido[1,2-a]pyrazine-9a-carbonitrile,octahydro-1-oxo-(9CI)
CAS Number:
50369-66-9
IUPAC Name:
1-oxo-3,4,6,7,8,9-hexahydro-2H-pyrido[1,2-a]pyrazine-9a-carbonitrile
InChI:
InChI=1S/C9H13N3O/c10-7-9-3-1-2-5-12(9)6-4-11-8(9)13/h1-6H2,(H,11,13)
InChI Key:
BGECCVTYLNSNPK-UHFFFAOYSA-N
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.106g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.223g/mol
Monoisotopic Mass:
179.106g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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