4-(Chloromethyl)-1H-imidazole hydrochloride (1:1)

Basic Information

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CAS Number

38585-61-4

Molecular Formula

C4H6Cl2N2

Molecular Weight

153.01 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

1400C

SMILES

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C1=C(NC=N1)CCl.Cl

InChI

InChI=1S/C4H5ClN2.ClH/c5-1-4-2-6-3-7-4;/h2-3H,1H2,(H,6,7);1H

InChIKey

FASMXPUFMXBVRL-UHFFFAOYSA-N

LogP

1.5702999999999996

Topological Polar Surface Area

28.68 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

57.7

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

A824201
1H-Imidazole, 4-(chloromethyl)-, monohydrochloride
DS-17607
4-(chloromethyl)-1h-imidazole hcl
4-Chloromethyl-1H-imidazole hydrochloride
AKOS026676161
1H-Imidazole, 5-(chloromethyl)-, hydrochloride (1:1)
Imidazole, 4-chloromethyl-, hydrochloride
4-(Chloromethyl)-1H-ImidazoleHydrochloride
BCP14266
A4961
DTXSID80191905
EN300-152996
SY041672
AM90206
4-chloromethyl-1H-imidazole hydrogen chloride
5-(CHLOROMETHYL)-1H-IMIDAZOLE HCL
NSC-82914
AB09871
4-CHLOROMETHYL-1(3)H-IMIDAZOLE HYDROCHLORIDE
4(5)-Chloromethylimidazole hydrochloride
FASMXPUFMXBVRL-UHFFFAOYSA-N
38585-61-4
CS-W005424
NSC82914
4-(CHLOROMETHYL)-1H-IMIDAZOLE, HCL
F1905-6450
4-(CHLOROMETHYL)IMIDAZOLE HYDROCHLORIDE
W-206853
4-(Chloromethyl)-1H-imidazole hydrochloride, AldrichCPR
4-(Chloromethyl)-1H-Imidazole Hydrochloride

MDL Number

MFCD01721661

FAQ

What regulatory guidelines apply to 4-(Chloromethyl)-1H-imidazole hydrochloride (CAS: 38585-61-4)?

4-(Chloromethyl)-1H-imidazole hydrochloride (CAS: 38585-61-4) falls under the GHS (Global Harmonized System of Classification and Labeling of Chemicals) and is classified as a hazardous chemical due to its corrosive properties. In the EU, it is regulated under REACH (Registration, Evaluation, Authorization and Restriction of Chemicals), requiring manufacturers and importers to register substances above 1 tonne per year. FDA and EPA have specific guidelines for the handling and disposal of such compounds in the United States.

Are there alternatives to 4-(Chloromethyl)-1H-imidazole hydrochloride (CAS: 38585-61-4) in synthesis?

Yes, there are a few alternatives in synthesis, such as 2-methylimidazole and 4-methylimidazole, which can be used as precursors. Other common reagents include 4-(hydroxymethyl)-1H-imidazole and 4-(aminomethyl)-1H-imidazole. These alternatives provide similar functionality but may offer better solubility or reactivity in certain applications.

What is the market or research trend for 4-(Chloromethyl)-1H-imidazole hydrochloride (CAS: 38585-61-4)?

The market for 4-(Chloromethyl)-1H-imidazole hydrochloride (CAS: 38585-61-4) is steadily growing, driven by its applications in pharmaceuticals, pesticides, and industrial solvents. Recent research trends focus on developing safer alternatives and exploring its use in new applications such as catalysis and nanotechnology. Price trends indicate a stable market with minor fluctuations based on supply and demand factors.

How should waste containing 4-(Chloromethyl)-1H-imidazole hydrochloride (CAS: 38585-61-4) be handled?

Waste containing 4-(Chloromethyl)-1H-imidazole hydrochloride (CAS: 38585-61-4) should be collected in appropriate containers and stored separately to prevent contamination. For disposal, it is recommended to consult local regulations, but generally, it should be incinerated or treated by a professional waste disposal service. Environmental precautions include neutralizing any acidic or basic materials before disposal to minimize environmental impact.