CAS 6159-05-3 | 1,1'-Diheptyl-[4,4'-bipyridine]-1,1'-diium bromide | CAS Number 6159-05-3

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6159-05-3 | 1,1'-Diheptyl-[4,4'-bipyridine]-1,1'-diium bromide

CAS No: 6159-05-3 Catalog No: AG003D8T MDL No:MFCD00011997

Product Description

Catalog Number:

AG003D8T

Chemical Name:

1,1'-Diheptyl-[4,4'-bipyridine]-1,1'-diium bromide

CAS Number:

6159-05-3

Molecular Formula:

C24H38Br2N2

Molecular Weight:

514.3799

MDL Number:

MFCD00011997

IUPAC Name:

1-heptyl-4-(1-heptylpyridin-1-ium-4-yl)pyridin-1-ium;dibromide

InChI:

InChI=1S/C24H38N2.2BrH/c1-3-5-7-9-11-17-25-19-13-23(14-20-25)24-15-21-26(22-16-24)18-12-10-8-6-4-2;;/h13-16,19-22H,3-12,17-18H2,1-2H3;2*1H/q+2;;/p-2

InChI Key:

VRXAJMCFEOESJO-UHFFFAOYSA-L

SMILES:

CCCCCCC[n+]1ccc(cc1)c1cc[n+](cc1)CCCCCCC.[Br-].[Br-]

EC Number:

228-178-7

Properties

Complexity:

282

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

514.138g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

514.39g/mol

Monoisotopic Mass:

512.14g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

7.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

Literature

Title	Journal
Ryanodine receptors are expressed in epidermal keratinocytes and associated with keratinocyte differentiation and epidermal permeability barrier homeostasis.	The Journal of investigative dermatology 20120101
Functional ryanodine receptors are expressed by human microglia and THP-1 cells: Their possible involvement in modulation of neurotoxicity.	Journal of neuroscience research 20070801