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Tris[4-(1-imidazolyl)phenyl]amine

Catalog Number
ACM1258947793-1
CAS Number
1258947-79-3
Product Name
Tris[4-(1-imidazolyl)phenyl]amine
Category
Nitrogen-containing MOF ligand-ternary nitrogen-containing MOF ligand
IUPAC Name
4-imidazol-1-yl-N,N-bis(4-imidazol-1-ylphenyl)aniline
Molecular Weight
443.5g/mol
Molecular Formula
C27H21N7
InChI
InChI=1S/C27H21N7/c1-7-25(8-2-22(1)31-16-13-28-19-31)34(26-9-3-23(4-10-26)32-17-14-29-20-32)27-11-5-24(6-12-27)33-18-15-30-21-33/h1-21H
InChI Key
XXDCQSZBEIDWSY-UHFFFAOYSA-N
Complexity
537
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
443.18584370g/mol
Formal Charge
0
Heavy Atom Count
34
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
443.18584370g/mol
Rotatable Bond Count
6
Stability
Tris[4-(1H-imidazol-1-yl)-phenyl]amine
Topological Polar Surface Area
56.7Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
4.4
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