1-(2,2,2-trifluoroethyl)piperazine hydrochloride - CAS 195447-63-3

Catalog:	BB015128
Product Name:	1-(2,2,2-trifluoroethyl)piperazine hydrochloride
CAS:	195447-63-3
Synonyms:	1-(2,2,2-trifluoroethyl)piperazine;hydrochloride; 1-(2,2,2-trifluoroethyl)piperazine;hydrochloride

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(2,2,2-trifluoroethyl)piperazine;hydrochloride
Description:	1-(2,2,2-trifluoroethyl)piperazine hydrochloride (CAS# 195447-63-3) is a useful research chemical.
Molecular Weight:	204.62
Molecular Formula:	C6H12ClF3N2
Canonical SMILES:	C1CN(CCN1)CC(F)(F)F.Cl
InChI:	InChI=1S/C6H11F3N2.ClH/c7-6(8,9)5-11-3-1-10-2-4-11;/h10H,1-5H2;1H
InChI Key:	KLOPWMOYEWBUOD-UHFFFAOYSA-N
LogP:	1.52260

Publication Number	Title	Priority Date
WO-2021055591-A1	Substituted benzimidazole carboxamides and their use in the treatment of medical disorders	20190917
WO-2020070332-A1	Oxindole compounds for use as map4k1 inhibitors	20181005
WO-2019238633-A1	New isoxazolyl ether derivatives as gaba a alpha5 pam	20180613
TW-202016106-A	Novel isoxazolate derivatives as GABA-AÎ±5 forward ectopic regulator (PAM)	20180613
BR-112020025355-A2	ISOXAZOLYL Ether DERIVATIVES AS GABA TO ALFA5 PAM	20180613

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Complexity:	118
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	204.0641106
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	204.0641106
Rotatable Bond Count:	1
Topological Polar Surface Area:	15.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0