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Home > Pyridines > 551919-57-4
551919-57-4 | Ethanone, 1-pyrazolo[1,5-b]pyridazin-3-yl- (9CI)
CAS No: 551919-57-4 Catalog No: AG00DT7J MDL No:MFCD13193721
Product Description
Catalog Number:
AG00DT7J
Chemical Name:
Ethanone, 1-pyrazolo[1,5-b]pyridazin-3-yl- (9CI)
CAS Number:
551919-57-4
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
MDL Number:
MFCD13193721
IUPAC Name:
1-pyrazolo[1,5-b]pyridazin-3-ylethanone
InChI:
InChI=1S/C8H7N3O/c1-6(12)7-5-10-11-8(7)3-2-4-9-11/h2-5H,1H3
InChI Key:
XAHXLPHHSIIXPR-UHFFFAOYSA-N
SMILES:
CC(=O)c1cnn2c1cccn2
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.164g/mol
Monoisotopic Mass:
161.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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