Home Pyridines 113682-56-7
113682-56-7,MFCD00445845
Catalog No.:AA000986
113682-56-7 | 1,4-Di(pyridin-4-yl)benzene
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100mg
97%
in stock  
$21.00   $15.00
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250mg
97%
in stock  
$29.00   $20.00
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1g
97%
in stock  
$95.00   $67.00
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5g
97%
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$379.00   $265.00
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  • Technical Information
  • Properties
  • Literature
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000986
Chemical Name:
1,4-Di(pyridin-4-yl)benzene
CAS Number:
113682-56-7
Molecular Formula:
C16H12N2
Molecular Weight:
232.2799
MDL Number:
MFCD00445845
IUPAC Name:
4-(4-pyridin-4-ylphenyl)pyridine
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
SMILES:
n1ccc(cc1)c1ccc(cc1)c1ccncc1
Properties
Computed Properties
 
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.1g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.286g/mol
Monoisotopic Mass:
232.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

Synonyms
 
1,4-DI(PYRIDIN-4-YL)BENZENE 
113682-56-7 
SCHEMBL135626 
CTK0C8940 
DTXSID90413261 
4,4'-(1,4-Phenylene)dipyridine 
4,4'-(1,4-Phenylene)bispyridine 
MFCD00445845 
ZINC33801680 
AKOS022186514 
ML01050 
AJ-86310 
1,4-Di(4-pyridyl)benzene 
AS-30027 
CJ-18103 
AX8283814 
FT-0707891 
P1550 
10.14272/MAWKLXRVKVOYLR-UHFFFAOYSA-N 
Z-2661 
doi:10.14272/MAWKLXRVKVOYLR-UHFFFAOYSA-N 
ACN-037906 
CID5250442 
Pyridine, 4,4'-(1,4-phenylene)bis- 
1,4-Di(4-pyridyl)benzene, 98% - 250MG 250mg 
AK146128 
1,4-bis(pyrid-4-yl)benzene 
4-(4-pyridin-4-ylphenyl)pyridine 
AC1NQMTC 
ACMC-20mis6 
1,4-bis(4-pyridyl)benzene 
Literature

Title: Synthetic and computational studies on factors controlling structures of molecular triangles and squares and their equilibrium in solutions.

Journal: Inorganic chemistry 20100215

Title: Flexible two-dimensional square-grid coordination polymers: structures and functions.

Journal: International journal of molecular sciences 20100101

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