1, 1'- (1, 6- Hexanediyl) bis- piperidine Dihydrochloride - CAS 88826-31-7

Catalog:	BB064157
Product Name:	1, 1'- (1, 6- Hexanediyl) bis- piperidine Dihydrochloride
CAS:	88826-31-7
Synonyms:	1,6-Di(piperidin-1-yl)hexane Dihydrochloride;Piperidine Impurity J

Technical Data

IUPAC Name:	1-(6-piperidin-1-ylhexyl)piperidinedihydrochloride
Description:	1, 1'- (1, 6- Hexanediyl) bis- piperidine Dihydrochloride is an impurity of Piperidine (P479985), which is an organic heterocyclic amine widely used as building block and reagent in the synthesis of organic compounds including pharmaceuticals.
Molecular Weight:	252.44 + 2(36.46)
Molecular Formula:	C16H32N2·2HCl
Canonical SMILES:	C1CCN(CC1)CCCCCCN2CCCCC2.Cl.Cl
InChI:	InChI=1S/C16H32N2.2ClH/c1(5-11-17-13-7-3-8-14-17)2-6-12-18-15-9-4-10-16-18/h1-16H22*1H
InChI Key:	UQOZNFXOYYQYFE-UHFFFAOYSA-N
References:	Reshmi, S.K., et al. J. Med. Plant. Res., 4, 1535 (2010); Wiles, J.A., et al. J. Med. Chem., 54, 3418 (2011).

Complexity:	171
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	3
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	324.2099045
Formal Charge:	0
Heavy Atom Count:	20
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	324.2099045
Rotatable Bond Count:	7
Topological Polar Surface Area:	6.5Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0