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Home > Imidazoles > 88710-47-8
88710-47-8 | 1H-Imidazo[4,5-d]pyridazine, 2-(2-methoxyphenyl)-
CAS No: 88710-47-8 Catalog No: AG0046ZP MDL No:
Product Description
Catalog Number:
AG0046ZP
Chemical Name:
1H-Imidazo[4,5-d]pyridazine, 2-(2-methoxyphenyl)-
CAS Number:
88710-47-8
Molecular Formula:
C12H10N4O
Molecular Weight:
226.2340
IUPAC Name:
2-(2-methoxyphenyl)-1H-imidazo[4,5-d]pyridazine
InChI:
InChI=1S/C12H10N4O/c1-17-11-5-3-2-4-8(11)12-15-9-6-13-14-7-10(9)16-12/h2-7H,1H3,(H,15,16)
InChI Key:
SFXCCPLZZNXDTM-UHFFFAOYSA-N
SMILES:
COc1ccccc1c1nc2c([nH]1)cnnc2
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.239g/mol
Monoisotopic Mass:
226.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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