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67227-90-1

67227-90-1 | Pyridine, 3,5-diethynyl- (9CI)

CAS No: 67227-90-1 Catalog No: AG00FH5E MDL No:MFCD11109669

Product Description

Catalog Number:
AG00FH5E
Chemical Name:
Pyridine, 3,5-diethynyl- (9CI)
CAS Number:
67227-90-1
MDL Number:
MFCD11109669
IUPAC Name:
3,5-diethynylpyridine
InChI:
InChI=1S/C9H5N/c1-3-8-5-9(4-2)7-10-6-8/h1-2,5-7H
InChI Key:
VERYSOHHELIELQ-UHFFFAOYSA-N

Properties

Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.042g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
127.146g/mol
Monoisotopic Mass:
127.042g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Literature

Title Journal
3,5-Bis(ethynyl)pyridine and 2,6-bis(ethynyl)pyridine spanning two Fe(Cp*)(dppe) units: role of the nitrogen atom on the electronic and magnetic couplings. Inorganic chemistry 20111219
3D coordination networks based on supramolecular chains as building units: synthesis and crystal structures of two silver(I) pyridyldiethynides. Inorganic chemistry 20080421

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