(2-Butyl-4-chloro-1H-imidazol-5-yl)methanol

Basic Information

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CAS Number

79047-41-9

Molecular Formula

C8H13ClN2O

Molecular Weight

188.66 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

147-151 °C

Boiling Point

407.7 oC at 760 mmHg

Density

1.236

Flash Point

407.7 oC at 760 mmHg

Refractive Index

1.554

SMILES

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CCCCC1=NC(=C(N1)CO)Cl

InChI

InChI=1S/C8H13ClN2O/c1-2-3-4-7-10-6(5-12)8(9)11-7/h12H,2-5H2,1H3,(H,10,11)

InChIKey

DXSZKDOOHOBZMT-UHFFFAOYSA-N

LogP

1.898

Topological Polar Surface Area

48.910000000000004 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

134

Safety Information

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Hazard Statement

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

5-Chloro-2-butylimidazole-4-methanol
SCHEMBL225
MFCD01934397
CHEBI:194618
2-Butyl-5-chloro-4-hydroxymethylimidazole
FT-0604611
2-Butyl-5-chloroimidazole-4-methanol
2-butyl-4-chloro-5-hydroxymethylimidazole
TS-00238
2-Butyl-4(5)-chloro-5(4)imidazolecarboxaldehyde
AKOS000278660
A9888
V39FKX4M92
2-Butyl-4-chloro-5-(hydroxymethyl)imidazole, 97%
2-butyl-4-chloro-1H-imidazol-5-ol;2-Butyl-4-chloro-5-(hydroxymethyl)imidazole
CS-W015982
(2-butyl-4-chloro-1H-imidazol-5-yl)methanol
D83212
AKOS006228099
SY263746
(2-Butyl-5-chloro-1H-imidazol-4-yl)methanol, AldrichCPR
2-butyl-4-chloro-1H-imidazole-5-methanol
2-butyl-4- chloro-5-(hydroxymethyl) imidazole
(2-Butyl-5-Chloro-1H-Imidazol-4-Yl)Methanol
79047-41-9
2-Butyl-4-chloro-5-hydroxymethyl-1H-imidazole
2-Butyl-4-chloro-5-(hydroxymethyl)imidazole
2-n-Butyl-4-chloro-5-hydroxymethylimidazole
1H-Imidazole-4-methanol, 2-butyl-5-chloro-
DTXSID10370867
DXSZKDOOHOBZMT-UHFFFAOYSA-N

MDL Number

MFCD01934397

Customs Code

2933290090

FAQ

What regulatory guidelines apply to (2-Butyl-4-chloro-1H-imidazol-5-yl)methanol (CAS: 79047-41-9)?

The compound (2-Butyl-4-chloro-1H-imidazol-5-yl)methanol (CAS: 79047-41-9) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH in the European Union, and FDA/EPA guidelines in the U.S. It is important to follow the specific labeling, storage, and handling instructions as required by these regulations to ensure safety and compliance.

Are there alternatives to (2-Butyl-4-chloro-1H-imidazol-5-yl)methanol (CAS: 79047-41-9) in synthesis?

Yes, there are alternative reagents that can be used in synthesis. For example, 2-Butyl-4-chloro-1H-imidazol-5-yl)acetamide can be considered as an alternative. Other potential substitutes include various imidazoles with different functional groups, which can provide similar functionalities but with varying properties and reactivities.

What is the market or research trend for (2-Butyl-4-chloro-1H-imidazol-5-yl)methanol (CAS: 79047-41-9)?

The market for (2-Butyl-4-chloro-1H-imidazol-5-yl)methanol (CAS: 79047-41-9) is driven by its applications in pharmaceuticals and agrochemicals. Recent research trends focus on its synthesis and modification, as well as its potential use as a precursor in the development of new drugs and pesticides. The demand is expected to grow as more applications are discovered and optimized.

How should waste containing (2-Butyl-4-chloro-1H-imidazol-5-yl)methanol (CAS: 79047-41-9) be handled?

Waste containing (2-Butyl-4-chloro-1H-imidazol-5-yl)methanol (CAS: 79047-41-9) should be collected in appropriate containers and stored separately to prevent contamination. It is recommended to incinerate the waste at an authorized facility or use a professional waste disposal service. Environmental precautions should be taken to ensure the waste is disposed of in a manner that complies with local regulations and minimizes environmental impact.