1-(4-Methoxyphenyl)piperazine Hydrochloride - CAS 84145-43-7

Catalog:	BB037136
Product Name:	1-(4-Methoxyphenyl)piperazine Hydrochloride
CAS:	84145-43-7
Synonyms:	1-(4-methoxyphenyl)piperazine;hydrochloride; 1-(4-methoxyphenyl)piperazine;hydrochloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-(4-methoxyphenyl)piperazine;hydrochloride
Description:	An intermediate in the synthesis of Itraconazole (I937500).
Molecular Weight:	228.72
Molecular Formula:	C11H17ClN2O
Canonical SMILES:	COC1=CC=C(C=C1)N2CCNCC2.Cl
InChI:	InChI=1S/C11H16N2O.ClH/c1-14-11-4-2-10(3-5-11)13-8-6-12-7-9-13;/h2-5,12H,6-9H2,1H3;1H
InChI Key:	HFJDUYKRPHHPAX-UHFFFAOYSA-N
Boiling Point:	344 °C at 760 mmHg
LogP:	2.30060

Publication Number	Title	Priority Date
US-10000452-B1	Quinolone-based compounds, formulations, and uses thereof	20160122
EP-2938608-A1	Small molecule agonists of neurotensin receptor 1	20121220
US-2015329497-A1	Small molecule agonists of neurotensin receptor 1	20121220
US-9868707-B2	Small molecule agonists of neurotensin receptor 1	20121220
WO-2014100501-A1	Small molecule agonists of neurotensin receptor 1	20121220

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Related Functional Groups

Piperazines

[1217482-26-2]
(R)-piperazin-2-ylmethanol dihydrochloride
[120-43-4]
Ethyl 1-piperazinecarboxylate
[1423024-26-3]
N''-(piperazine-1-carboximidoyl)guanidine trihydrochloride
[2171065-77-1]
N1-(2-(4-(4-chloro-2-fluorophenyl)piperazin-1-yl)phenyl)-N4,N4-dimethylbenzene-1,4-disulfonamide
[215190-22-0]
Fmoc-piperazine hydrochloride
[1900-04-5]
1-(1,2,3,4-Tetrahydronaphthalen-2-yl)piperazine

GHS Hazard Statement:	H301 (20%): 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

Complexity:	161
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