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86042-69-5 | Pyridinium, 1,1'-methylenebis-
CAS No: 86042-69-5 Catalog No: AG004LRJ MDL No:
Product Description
Catalog Number:
AG004LRJ
Chemical Name:
Pyridinium, 1,1'-methylenebis-
CAS Number:
86042-69-5
Molecular Formula:
C11H12N2++
Molecular Weight:
172.2264
IUPAC Name:
1-(pyridin-1-ium-1-ylmethyl)pyridin-1-ium
InChI:
InChI=1S/C11H12N2/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-10H,11H2/q+2
InChI Key:
JOICOUCDZBPSHL-UHFFFAOYSA-N
SMILES:
c1cc[n+](cc1)C[n+]1ccccc1
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.1g/mol
Formal Charge:
2
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.231g/mol
Monoisotopic Mass:
172.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
7.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| 1,1'-Methylenedipyridinium tetrachloridocuprate(II) and bis[tetrachloridoaurate(III)] hybrid salts by X-ray powder diffraction. | Acta crystallographica. Section C, Crystal structure communications 20120901 |
| Reaction of dichloromethane with pyridine derivatives under ambient conditions. | The Journal of organic chemistry 20100618 |
| 1,1'-Methyl-enedipyridinium dichloride monohydrate. | Acta crystallographica. Section E, Structure reports online 20100501 |
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