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1,4-bis(pyrid-4-yl)benzene

Catalog Number
ACM113682567-2
CAS Number
113682-56-7
Product Name
1,4-bis(pyrid-4-yl)benzene
Structure
Category
Nitrogen-containing MOF ligand-binary nitrogen-containing MOF ligand
IUPAC Name
4-(4-pyridin-4-ylphenyl)pyridine
Molecular Weight
232.28g/mol
Molecular Formula
C16H12N2
InChI
InChI=1S/C16H12N2/c1-2-14(16-7-11-18-12-8-16)4-3-13(1)15-5-9-17-10-6-15/h1-12H
InChI Key
MAWKLXRVKVOYLR-UHFFFAOYSA-N
Complexity
208
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
232.100048391g/mol
Formal Charge
0
Heavy Atom Count
18
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
232.100048391g/mol
Rotatable Bond Count
2
Topological Polar Surface Area
25.8Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
3
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