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Home > Pyridines > 162022-91-5
162022-91-5 | Pyrido[3,4-d]pyridazine, 4-methoxy-
CAS No: 162022-91-5 Catalog No: AG001SNE MDL No:
Product Description
Catalog Number:
AG001SNE
Chemical Name:
Pyrido[3,4-d]pyridazine, 4-methoxy-
CAS Number:
162022-91-5
Molecular Formula:
C8H7N3O
Molecular Weight:
161.1607
IUPAC Name:
4-methoxypyrido[3,4-d]pyridazine
InChI:
InChI=1S/C8H7N3O/c1-12-8-7-5-9-3-2-6(7)4-10-11-8/h2-5H,1H3
InChI Key:
LSSIWYQSBHISRM-UHFFFAOYSA-N
SMILES:
COc1nncc2c1cncc2
Properties
Complexity:
153
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:
4
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:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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