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160911-42-2 | Imidazo[1,2-b]pyridazine-2-carboxylic acid (9CI)
CAS No: 160911-42-2 Catalog No: AG001VHS MDL No:MFCD08235229
Product Description
Catalog Number:
AG001VHS
Chemical Name:
Imidazo[1,2-b]pyridazine-2-carboxylic acid (9CI)
CAS Number:
160911-42-2
Molecular Formula:
C7H5N3O2
Molecular Weight:
163.1335
MDL Number:
MFCD08235229
IUPAC Name:
imidazo[1,2-b]pyridazine-2-carboxylic acid
InChI:
InChI=1S/C7H5N3O2/c11-7(12)5-4-10-6(9-5)2-1-3-8-10/h1-4H,(H,11,12)
InChI Key:
ONVUCPOYNIOJFY-UHFFFAOYSA-N
SMILES:
OC(=O)c1cn2c(n1)cccn2
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.038g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.136g/mol
Monoisotopic Mass:
163.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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