4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole

Basic Information

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CAS Number

113775-47-6

Molecular Formula

C13H16N2

Molecular Weight

200.28 g/mol

Basic Physical Properties

Melting Point

146-149°C

Boiling Point

381.9℃ at 760mmHg

Flash Point

191.3°C

Refractive Index

1.569

SMILES

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C[C@H](c1c[nH]cn1)c2cccc(C)c2C

InChI

InChI=1S/C13H16N2/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13/h4-8,11H,1-3H3,(H,14,15)/t11-/m0/s1

InChIKey

CUHVIMMYOGQXCV-NSHDSACASA-N

LogP

3.1783400000000013

Topological Polar Surface Area

28.68 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

205

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

1H-Imidazole,5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-
Dexmedetomidine
(S)-medetomidine
5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole
Dexmedetomidina
Dexmedetomidinum
(+)-Medetomidine
MPV 1440
d-Medetomidine
DexmedetomidineHclC13H16N2.Hcl
4-[(S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole
(S)-5-(1-(2,3-diMethylphenyl)ethyl)-1H-iMidazole
(S)-4-[1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole
Dexmedetomidine Hcl C13H16N2.Hcl 145108-58-3(Hcl)
Dexmedetomidine Impurity
Precedex
Dexdor
(+)-4-((S)-alpha,2,3-Trimethylbenzyl)imidazole
Precedex (TN)
67VB76HONO
4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole
Dexmedetomidinum [INN-Latin]
Dexmedetomidina [INN-Spanish]
1H-Imidazole, 4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-
Dexmedetomidine [USAN:INN:BAN]
(+)-(S)-4-[1-(2,3-dimethylphenyl) ethyl]-1H -imidazole

MDL Number

MFCD22683655

Customs Code

2933290090

FAQ

What is 4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole (CAS: 113775-47-6)?

4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole (CAS: 113775-47-6) is a chemical compound with a molecular structure that includes an imidazole ring and a 2,3-dimethylphenyl substituent. This compound is known for its unique chemical properties, such as its ability to form stable complexes with metal ions and its use in various applications.

What are the main uses of 4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole (CAS: 113775-47-6)?

4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole (CAS: 113775-47-6) is primarily used in pharmaceuticals for its antifungal and antimicrobial properties. It is also utilized in research and development for studying metal complexes and as a chelating agent in various industrial applications.

Is 4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole (CAS: 113775-47-6) safe?

4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole (CAS: 113775-47-6) is generally considered safe when used according to its intended applications, such as in pharmaceutical formulations. However, it is important to follow safety precautions, including proper handling, storage, and disposal to avoid potential skin irritation or respiratory issues. Protective gloves and eyewear should be worn during handling.

How should 4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole (CAS: 113775-47-6) be stored?

4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole (CAS: 113775-47-6) should be stored in a cool, dry place away from direct sunlight and heat sources to maintain its stability. It is recommended to store it in a tightly sealed container to prevent moisture and degradation. The storage temperature should be kept below 25°C (77°F) to ensure optimal chemical properties.