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N,N'-(1,4-phenylene)diisonicotinamide

Catalog Number
ACM55119421-2
CAS Number
55119-42-1
Product Name
N,N'-(1,4-phenylene)diisonicotinamide
Category
Customizable MOF Linkers
Synonyms
N-[4-(Pyridine-4-carbonylamino)phenyl]pyridine-4-carboxamide; N,N'-Bis-(4-pyridylformamide)-1,4-benzenediamine
IUPAC Name
N-[4-(pyridine-4-carbonylamino)phenyl]pyridine-4-carboxamide
Molecular Weight
318.33
Molecular Formula
C18H14N4O2
InChI
InChI=1S/C18H14N4O2/c23-17(13-5-9-19-10-6-13)21-15-1-2-16(4-3-15)22-18(24)14-7-11-20-12-8-14/h1-12H,(H,21,23)(H,22,24)
InChI Key
VFVBSQVONILYDC-UHFFFAOYSA-N
Purity
98%
Complexity
383
Compound Is Canonicalized
Yes
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
318.11167570g/mol
Formal Charge
0
Heavy Atom Count
24
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
2
Isotope Atom Count
0
Monoisotopic Mass
318.11167570g/mol
NSC Number
338578
Rotatable Bond Count
4
Topological Polar Surface Area
84Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
XLogP3
1.5
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