1-(2-Methoxyphenyl)piperazine hydrochloride - CAS 5464-78-8

Name: 1-(2-Methoxyphenyl)piperazine hydrochloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB028748
Product Name:	1-(2-Methoxyphenyl)piperazine hydrochloride
CAS:	5464-78-8
Synonyms:	N-(2-Methoxyphenyl)piperazine hydrochloride; Piperazine, 1-(2-methoxyphenyl)-, monohydrochloride

Technical Data

Related CAS:	35386-24-4 (free base) 38869-49-7 (dihydrochloride)
IUPAC Name:	1-(2-methoxyphenyl)piperazine;hydrochloride
Description:	An impurity of Urapidil. Urapidil is an α1-adrenoceptor antagonist and an 5-HT1A receptor agonist that is used as an antihypertensive agent.
Molecular Weight:	228.72
Molecular Formula:	C11H17ClN2O
Canonical SMILES:	COC1=CC=CC=C1N2CCNCC2.Cl
InChI:	InChI=1S/C11H16N2O.ClH/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13;/h2-5,12H,6-9H2,1H3;1H
InChI Key:	DDMVHGULHRJOEC-UHFFFAOYSA-N
Boiling Point:	379.9 °C at 760 mmHg
Density:	1.057 g/cm³
Solubility:	Soluble in DMSO and Methanol
Appearance:	White to Off-White Solid
MDL:	MFCD00012762
LogP:	2.30060

GHS Hazard Statement:	H301 (40%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021050980-A1	Druggable target to treat retinal degeneration	20190913
CN-109516960-B	Preparation method of urapidil hydrochloride	20181226
WO-2020020097-A1	Pyrazolotriazolopyrimidine derivatives as a2a receptor antagonist	20180723
TW-202016116-A	Pyrazolotriazolopyrimidine derivatives as A2A receptor antagonists	20180723
CN-112469722-A	Pyrazolo-triazolopyrimidine derivatives as A2A receptor antagonists	20180723

PMID	Publication Date	Title	Journal
22235758	20120101	Anti-biofilm activity of Salvadora persica on cariogenic isolates of Streptococcus mutans: in vitro and molecular docking studies	Biofouling
21821420	20110901	Synthesis and in vivo evaluation of [O-methyl-11C] N-[3,5-dichloro-2-(methoxy)phenyl]-4-(methoxy)-3-(1-piperazinyl)benzenesulfonamide as an imaging probe for 5-HT6 receptors	Bioorganic & medicinal chemistry
19734910	20091001	Genetic mapping of targets mediating differential chemical phenotypes in Plasmodium falciparum	Nature chemical biology
17869179	20080701	Underestimation of toluene diisocyanate concentration using long-term sampling with 1-(2-methoxyphenyl) piperazine impregnated filters	International journal of hygiene and environmental health
17710644	20070901	Omptin proteins: an expanding family of outer membrane proteases in Gram-negative Enterobacteriaceae	Molecular membrane biology

Complexity:	169
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	228.1029409
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	228.1029409
Rotatable Bond Count:	2
Topological Polar Surface Area:	24.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0