2-[1-(2,6-Dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole hydrochloride (1:1)

Basic Information

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CAS Number

21498-08-8

Molecular Formula

C11H13Cl3N2O

Molecular Weight

295.6 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

230-232°C

Solubility

H2O: soluble20mg/mL, clear

SMILES

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CC(C1=NCCN1)OC2=C(C=CC=C2Cl)Cl.Cl

InChI

InChI=1S/C11H12Cl2N2O.ClH/c1-7(11-14-5-6-15-11)16-10-8(12)3-2-4-9(10)13;/h2-4,7H,5-6H2,1H3,(H,14,15);1H

InChIKey

DWWHMKBNNNZGHF-UHFFFAOYSA-N

LogP

3.184200000000002

Topological Polar Surface Area

33.620000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

263

Safety Information

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GHS Hazard Pictograms

H301

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1 Class 6.1

Toxicity

LD50 in mice, rats, dogs (mg/kg): between 74-147 orally (all species); between 8-18 i.v. (all species) (Tsai)

Synonyms & References

English

Lofexidine (TN)
Q27291521
LOFEXIDINE HYDROCHLORIDE [WHO-DD]
Lofetensin hydrochloride
2-[1-(2,6-dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole;hydrochloride
2-(1-(2,6-Dichlorophenoxy)ethyl)-2-imidazoline hydrochloride
Lofexidine HCl;Lofexidine monohydrochloride;Baq-168; MDL-14042;BA 168;MDL 14,042
CHEMBL1788132
NSC759654
J-014106
MFCD00917022
DTXCID60781
Lofexidine hydrochloride (USAN)
BCP30600
HY-B1052
LOFEXIDINE HYDROCHLORIDE [MI]
Loxacor hydrochloride
(-)-2-[1-(2,6-dichlorophenoxy)-ethyl]-1,3-diazacyclopent-2-ene hydrochloride
BA 168
Lucemyra
LOFEXIDINE HCl
2-[1-(2,6-Dichlorophenoxy)ethyl]-2-imidazoline monohydrochloride
DWWHMKBNNNZGHF-UHFFFAOYSA-N
AS-31095
Britlofex
2-(1-(2,6-Dichlorophenoxy)ethyl)-4,5-dihydro-1H-imidazolehydrochloride
Lofexidine (hydrochloride)
Lofexidine mono-hydrochloride
CS-4574
Lofexidine hydrochloride
2-{1-[(2,6-dichlorophenyl)oxy]ethyl}-4,5-dihydro-1H-imidazole hydrochloride

MDL Number

MFCD00917022

Customs Code

2933290090

FAQ

What regulatory guidelines apply to 2-[1-(2,6-Dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole hydrochloride (CAS: 21498-08-8)?

The compound 2-[1-(2,6-Dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole hydrochloride (CAS: 21498-08-8) is subject to GHS classification for hazardous chemicals, REACH regulations for chemical safety in the European Union, and FDA/EPA requirements for registration and control of pesticide and pharmaceutical substances. It must comply with local and international safety standards and regulations regarding its production, storage, and transportation.

Are there alternatives to 2-[1-(2,6-Dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole hydrochloride (CAS: 21498-08-8) in synthesis?

There are alternative reagents and synthesis methods available for producing compounds similar to 2-[1-(2,6-Dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole hydrochloride (CAS: 21498-08-8), such as 2-chloro-4,6-dichlorophenol or 2,4-dichlorophenol, which can be used as starting materials or intermediates in different synthetic routes. These alternatives can offer similar functionalities while potentially reducing environmental concerns.

What is the market or research trend for 2-[1-(2,6-Dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole hydrochloride (CAS: 21498-08-8)?

The market for 2-[1-(2,6-Dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole hydrochloride (CAS: 21498-08-8) reflects growing interest in its potential applications in agriculture and pharmaceuticals. Research trends focus on optimizing its efficacy and safety, as well as exploring its role in pest control and antifungal activities. Additionally, there is an increasing focus on sustainable alternatives and environmentally friendly formulations.

How should waste containing 2-[1-(2,6-Dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole hydrochloride (CAS: 21498-08-8) be handled?

Waste containing 2-[1-(2,6-Dichlorophenoxy)ethyl]-4,5-dihydro-1H-imidazole hydrochloride (CAS: 21498-08-8) should be collected in appropriate containers and safely transported to designated hazardous waste facilities. Incineration or professional waste disposal methods should be used to ensure proper destruction of the compound. Environmental protection measures, such as minimizing exposure and following local disposal regulations, are essential to prevent contamination of soil and water resources.