1-(4-Chlorobenzyl)piperazine - CAS 23145-88-2

Catalog:	BB017950
Product Name:	1-(4-Chlorobenzyl)piperazine
CAS:	23145-88-2
Synonyms:	1-[(4-chlorophenyl)methyl]piperazine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-[(4-chlorophenyl)methyl]piperazine
Description:	1-(4-Chlorobenzyl)piperazine (CAS# 23145-88-2) is an inhibitor of [3H]5-HT uptake into rat brain synaptosomes. Also inhibits the acute effects of MDMA.
Molecular Weight:	210.70
Molecular Formula:	C11H15ClN2
Canonical SMILES:	C1CN(CCN1)CC2=CC=C(C=C2)Cl
InChI:	InChI=1S/C11H15ClN2/c12-11-3-1-10(2-4-11)9-14-7-5-13-6-8-14/h1-4,13H,5-9H2
InChI Key:	GSJXJZOWHSTWOX-UHFFFAOYSA-N
Boiling Point:	120 °C (1 torr)
Purity:	> 98 %
Density:	1.140 g/cm³
Appearance:	Clear yellow liquid
MDL:	MFCD00040791
LogP:	2.01190

Publication Number	Title	Priority Date
CN-111879767-A	Color development test method of piperazine novel mental active substance	20200729
CN-113214275-A	Pyranocarbazole alkaloid derivatives and their use for treating nervous system diseases	20200204
CN-110615774-A	Benzyl piperazine compound with anti-inflammatory activity, preparation method and medical application	20190919
CN-109748884-A	A kind of iron death inhibitor and the preparation method and application thereof	20190219
US-2020247785-A1	IL-17 Ligands And Uses Thereof	20190206

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Related Functional Groups

Piperazines

[25629-32-7]
(3-Oxopiperazin-1-yl)acetic acid
[1217482-26-2]
(R)-piperazin-2-ylmethanol dihydrochloride
[16017-53-1]
1-(4-Chloro-benzenesulfonyl)-piperazine
[1191255-65-8]
Ethyl [4-(3,3,3-trifluoropropyl)piperazin-1-yl]acetate
[104481-24-5]
Ethyl 2-piperazin-1-yl-thiazole-4-carboxylate
[1197236-47-7]
Ethyl 4-[2-(4-amino-3-methylpyrazol-1-yl)propanoyl]piperazine-1-carboxylate hydrochloride

GHS Hazard Statement:	H302 (99.49%): Harmful if swallowed [Warning Acute toxicity, oral]; H314 (99.49%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501
Signal Word:	Danger

Complexity:	161
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	210.0923762
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	210.0923762
Rotatable Bond Count:	2
Topological Polar Surface Area:	15.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7