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Home > Imidazoles > 2102411-59-4
2102411-59-4 | imidazo[1,2-b]pyridazin-8(5H)-one
CAS No: 2102411-59-4 Catalog No: AG01DTJ9 MDL No:
Product Description
Catalog Number:
AG01DTJ9
Chemical Name:
imidazo[1,2-b]pyridazin-8(5H)-one
CAS Number:
2102411-59-4
Molecular Formula:
C6H5N3O
Molecular Weight:
135.1234
IUPAC Name:
5,6,7,8a-tetrahydro-1H-imidazo[1,2-b]pyridazin-8-one
InChI:
InChI=1S/C6H9N3O/c10-5-1-2-8-9-4-3-7-6(5)9/h3-4,6-8H,1-2H2
InChI Key:
GTPCLGWFKLSJES-UHFFFAOYSA-N
SMILES:
O=c1cc[nH]n2c1ncc2
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.075g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
139.158g/mol
Monoisotopic Mass:
139.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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