2-(2-Pyrrolidinyl)acetic Acid Hydrochloride - CAS 71985-79-0

Name: 2-(2-Pyrrolidinyl)acetic Acid Hydrochloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB034508
Product Name:	2-(2-Pyrrolidinyl)acetic Acid Hydrochloride
CAS:	71985-79-0
Synonyms:	2-(2-pyrrolidinyl)acetic acid;hydrochloride; 2-pyrrolidin-2-ylacetic acid;hydrochloride

Technical Data

IUPAC Name:	2-pyrrolidin-2-ylacetic acid;hydrochloride
Description:	2-(2-Pyrrolidinyl)acetic Acid Hydrochloride (CAS# 71985-79-0) is the hydrochloride salf form of (+/-)-Homoproline (H605005).(+/-)-Homoproline was isolated from Melampodium divaricatum and is a GABA-uptake inhibitor derived from proline.
Molecular Weight:	165.62
Molecular Formula:	C6H12ClNO2
Canonical SMILES:	C1CC(NC1)CC(=O)O.Cl
InChI:	InChI=1S/C6H11NO2.ClH/c8-6(9)4-5-2-1-3-7-5;/h5,7H,1-4H2,(H,8,9);1H
InChI Key:	VQDACVOAOJQTPR-UHFFFAOYSA-N
LogP:	1.34390

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2020052631-A1	Triazolo-pyrimidine compounds and uses thereof	20180912
US-10858365-B2	Triazolo-pyrimidine compounds and uses thereof	20180912
US-2020331918-A1	Triazolo-pyrimidine compounds and uses thereof	20180912
US-2021009600-A1	Triazolo-pyrimidine compounds and uses thereof	20180912
US-10550105-B2	Pyridazinones as PARP7 inhibitors	20180430

Complexity:	114
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	165.0556563
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	165.0556563
Rotatable Bond Count:	2
Topological Polar Surface Area:	49.3 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0