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Home > Pyridines > 100595-17-3
100595-17-3 | 9H-Indeno[2,1-c]pyridazine
CAS No: 100595-17-3 Catalog No: AG0002FA MDL No:
Product Description
Catalog Number:
AG0002FA
Chemical Name:
9H-Indeno[2,1-c]pyridazine
CAS Number:
100595-17-3
Molecular Formula:
C11H8N2
Molecular Weight:
168.1946
IUPAC Name:
9H-indeno[2,1-c]pyridazine
InChI:
InChI=1S/C11H8N2/c1-2-4-9-8(3-1)7-11-10(9)5-6-12-13-11/h1-6H,7H2
InChI Key:
STGMORHGPQLXMT-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)Cc1c2ccnn1
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.199g/mol
Monoisotopic Mass:
168.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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