(S)-1-Benzylpyrrolidine-3-carboxylic Acid Hydrochloride - CAS 1212293-24-7

Catalog:	BB061581
Product Name:	(S)-1-Benzylpyrrolidine-3-carboxylic Acid Hydrochloride
CAS:	1212293-24-7
Synonyms:	(s)-1-benzyl-pyrrolidine-3-carboxylic acid hydrochloride; (s)-1-benzylpyrrolidine-3-carboxylic acid hydrochloride; (S)-1-N-Benzyl-beta-proline, HCl; (S)-1-BENZYLPYRROLIDINE-3-CARBOXYLIC ACID HCL; (3S)-1-benzylpyrrolidine-3-carboxylic acid; hydrochloride; (s)-1-benzyl-beta-proline hcl; (S)-1-Benzyl-pyrrolidine-3-carboxylic acid HCl

Technical Data

IUPAC Name:	(3S)-1-benzylpyrrolidine-3-carboxylic acidhydrochloride
Description:	(S)-1-Benzylpyrrolidine-3-carboxylic Acid Hydrochloride is used as a reactant in the preparation of N-indolylalkyl heteroarylcarboxamide derivatives as TAU-induced toxicity inhibitors useful in the treatment of neurodegenerative diseases.
Molecular Weight:	241.71
Molecular Formula:	C12H15NO2·HCl
Canonical SMILES:	C1CN(CC1C(=O)O)CC2=CC=CC=C2.Cl
InChI:	InChI=1S/C12H15NO2.ClH/c14-12(15)11-6-7-13(9-11)8-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,14,15)1H/t11-/m0./s1
InChI Key:	LFWISXSUMOTUQQ-MERQFXBCSA-N
Solubility:	Aqueous Base (Slightly), Methanol (Slightly), Water (Slightly)
Appearance:	Off-White to Pale Red Solid
Storage:	-20°C, Hygroscopic
References:	Griffioen, Gerard, et al. Katholieke Universiteit Leuven, WO 2010142801 A1 20101216 (2010).

Complexity:	224
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	241.0869564
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	241.0869564
Rotatable Bond Count:	3
Topological Polar Surface Area:	40.5Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0