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82531-21-3

82531-21-3 | 1,5-Bis[bis(2-pyridinyl)methylene]carbonohydrazide

CAS No: 82531-21-3 Catalog No: AG00GMHL MDL No:

Product Description

Catalog Number:
AG00GMHL
Chemical Name:
1,5-Bis[bis(2-pyridinyl)methylene]carbonohydrazide
CAS Number:
82531-21-3
IUPAC Name:
1,3-bis(dipyridin-2-ylmethylideneamino)urea
InChI:
InChI=1S/C23H18N8O/c32-23(30-28-21(17-9-1-5-13-24-17)18-10-2-6-14-25-18)31-29-22(19-11-3-7-15-26-19)20-12-4-8-16-27-20/h1-16H,(H2,30,31,32)
InChI Key:
UHHHWYCOSNWJTQ-UHFFFAOYSA-N

Properties

Complexity:
572  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
422.16g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
422.452g/mol
Monoisotopic Mass:
422.16g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

Literature

Title Journal
2-[({[Bis(pyridin-2-yl)methylidene]hydrazinecarbonyl}hydrazinylidene)(pyridin-2-yl)methyl]pyridinium tetra-fluoro-borate. Acta crystallographica. Section E, Structure reports online 20110801

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