Spiro[indane-2,4'-piperidine] - CAS 6841-89-0

Catalog:	BB057767
Product Name:	Spiro[indane-2,4'-piperidine]
CAS:	6841-89-0
Synonyms:	1,3-Dihydrospiro[2H-indene-2,4'-piperidine]; 1,3-Dihydrospiro[indene-2,4'-piperidine]; Spiro[indane-2,4'-piperidine]; Spiro[indan-2,4'-piperidine] (8CI)

Technical Data

IUPAC Name:	spiro[1,3-dihydroindene-2,4'-piperidine]
Description:	Spiro[indane-2,4'-piperidine] is used in the synthetic preparation of heterocyclic derivatives as inhibitors of ion channels useful in treatment of various disorders.
Molecular Weight:	187.28
Molecular Formula:	C13H17N
Canonical SMILES:	C1CNCCC12CC3=CC=CC=C3C2
InChI:	InChI=1S/C13H17N/c1-2-4-12-10-13(9-11(12)3-1)5-7-14-8-6-13/h1-4,14H,5-10H2
InChI Key:	AJOICBZPOILCTP-UHFFFAOYSA-N
References:	Wilson, D.; et al. PCT Int. Appl. 369 pp. Patent 2007 CODEN:PIXXD2.

Complexity:	189
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	187.136099547
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	187.136099547
Rotatable Bond Count:	0
Topological Polar Surface Area:	12Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4