(2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone

Basic Information

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CAS Number

91874-85-0

Molecular Formula

C12H12N2O

Molecular Weight

200.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

412.7±33.0°C at 760 mmHg

Density

1.166±0.06 g/cm3 (20 ºC 760 Torr),

SMILES

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CC1=C(C(=CC=C1)C(=O)C2=CN=CN2)C

InChI

InChI=1S/C12H12N2O/c1-8-4-3-5-10(9(8)2)12(15)11-6-13-7-14-11/h3-7H,1-2H3,(H,13,14)

InChIKey

RXMJMOMMINVJMY-UHFFFAOYSA-N

LogP

2.2575399999999997

Topological Polar Surface Area

45.75 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

242

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

(2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone
(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methanone
4(5)-(2,3-Dimethylbenzoyl)imidazole
Methanone, (2,3-dimethylphenyl)-1H-imidazol-4-yl- chemistry
Medetomidine Impurity 6
Methanone, (2,3-dimethylphenyl)-1H-imidazol-4-yl-
4-(2',3'-Dimethylbenzoyl)imidazole
AK128046
(2,3-Dimethylphenyl)(1H-imidazol-5-yl)methanone
BCP30915
LS41168
AX8249837
AM20080951
ST24033711
Methanone, (2,3-dimethylphenyl)-1H-imidazol-5-yl-
(2,3-dimethylphenyl)-(1H-imidazo
(2,3-Dimethylphenyl)-1H-imidazol-5-ylmethanone (ACI)
Methanone, (2,3-dimethylphenyl)-1H-imidazol-4-yl- (9CI)
J-500572
(2,3-dimethylphenyl)-1H-imidazol-4-ylmethanone
SCHEMBL11049910
4-(2,3-DIMETHYLBENZOYL)-1H-IMIDAZOLE
CS-W007117
DTXSID10577819
(2,3-Dimethylphenyl)-1H-imidazol-5-ylmethanone
SCHEMBL21401257
DS-5722
(2,3-Dimethylphenyl)(4-imidazolyl)methanone
91874-85-0
O10031
AKOS016013473

MDL Number

MFCD21332884

FAQ

What is (2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone (CAS: 91874-85-0)?

(2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone (CAS: 91874-85-0) is an organic compound with a molecular structure featuring a 2,3-dimethylphenyl group and a 1H-imidazol-4-yl group linked through a methanone moiety. It is typically a white or off-white solid at room temperature, with a melting point around 112-113°C. This compound is used in various applications, including pharmaceuticals and research.

What are the main uses of (2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone (CAS: 91874-85-0)?

(2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone (CAS: 91874-85-0) is primarily used in pharmaceutical research and development, as it can serve as a precursor or intermediate in the synthesis of other compounds. It is also utilized in various industrial applications, such as polymer synthesis and as a solvent.

Is (2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone (CAS: 91874-85-0) safe?

(2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone (CAS: 91874-85-0) is generally considered safe for laboratory use under proper handling conditions. However, it should be used with caution, and appropriate personal protective equipment (PPE) such as gloves and goggles should be worn. It is important to follow safety guidelines and avoid prolonged exposure.

How should (2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone (CAS: 91874-85-0) be stored?

(2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone (CAS: 91874-85-0) should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to keep it in a sealed container to prevent degradation. Ideal storage conditions are below 25°C. Take care to avoid contact with incompatible materials and dispose of any unused compound according to local regulations.