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1,3,6,8-Tetra(pyridin-4-yl)pyrene

Catalog Number
ACM1402429804-2
Product Name
1,3,6,8-Tetra(pyridin-4-yl)pyrene
CAS
1402429-80-4
Category
Nitrogen-containing MOF ligand-multiple nitrogen-containing MOF ligand
Synonyms
4-[3,6,8-Tris(pyridin-4-yl)pyren-1-yl]pyridine
IUPAC Name
4-(3,6,8-tripyridin-4-ylpyren-1-yl)pyridine
Molecular Weight
510.59
Molecular Formula
C36H22N4
InChI
InChI=1S/C36H22N4/c1-2-28-32(24-7-15-38-16-8-24)22-34(26-11-19-40-20-12-26)30-4-3-29-33(25-9-17-39-18-10-25)21-31(23-5-13-37-14-6-23)27(1)35(29)36(28)30/h1-22H
InChI Key
LKYWKMLWYLQWJF-UHFFFAOYSA-N
Purity
97%
Appearance
Yellow solid
Complexity
691
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
510.18444672g/mol
Formal Charge
0
Heavy Atom Count
40
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
510.18444672g/mol
Rotatable Bond Count
4
Topological Polar Surface Area
51.6Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
7.3
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