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Home > Imidazoles > 951626-36-1
951626-36-1 | 5H,6H,7H,8H-imidazo[1,5-a]pyrazin-8-one
CAS No: 951626-36-1 Catalog No: AG01BI9I MDL No:MFCD09832033
Product Description
Catalog Number:
AG01BI9I
Chemical Name:
5H,6H,7H,8H-imidazo[1,5-a]pyrazin-8-one
CAS Number:
951626-36-1
Molecular Formula:
C6H7N3O
Molecular Weight:
137.1393
MDL Number:
MFCD09832033
IUPAC Name:
6,7-dihydro-5H-imidazo[1,5-a]pyrazin-8-one
InChI:
InChI=1S/C6H7N3O/c10-6-5-3-7-4-9(5)2-1-8-6/h3-4H,1-2H2,(H,8,10)
InChI Key:
WXWQYMIMMRLBAN-UHFFFAOYSA-N
SMILES:
O=C1NCCn2c1cnc2
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
137.142g/mol
Monoisotopic Mass:
137.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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