Methyl 1H-imidazole-4-carboxylate

Basic Information

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CAS Number

17325-26-7

Molecular Formula

C5H6N2O2

Molecular Weight

126.12 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

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

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Physical State

White to Yellow Solid

Melting Point

154-156 °C

Boiling Point

318.2°C at 760 mmHg

Density

1.275

Flash Point

146.2°C

Refractive Index

1.53

SMILES

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COC(=O)C1=CN=CN1

InChI

InChI=1S/C5H6N2O2/c1-9-5(8)4-2-6-3-7-4/h2-3H,1H3,(H,6,7)

InChIKey

DVLGIQNHKLWSRU-UHFFFAOYSA-N

LogP

0.19629999999999997

Topological Polar Surface Area

54.98 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

116

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

methyl 4-imidazole carboxylate
P10322
Imidazole-4-carboxylic acid methylester
DTXSID50340564
MFCD00216584
4-Methoxycarbonylimidazole
1H-imidazole-4-carboxylic acid methyl ester
1H-Imidazole-4-carboxylic acid, methyl ester
Methyl 1H-imidazole-4-carboxylate
17325-26-7
AC-6895
3H-Imidazole-4-carboxylic acid methyl ester
Methyl 1H-Imidazole-5-Carboxylate
methyl-4-imidazole carboxylate
HMS2234P21
Methyl1H-Imidazole-5-Carboxylate
1H-Imidazole-5-carboxylic Acid Methyl Ester
CHEMBL1866040
PB18686
Imidazol-4-carbonic acid methylester
BS-3757
SMR000568403
SY019856
Methyl 4-imidazolecarboxylate, 98%
Methyl 1H-imidazole-4-carboxylate #
FT-0648439
EN300-64187
4-(Methoxycarbonyl)imidazole
AM20090030
Q-103100
CS-W002529

MDL Number

MFCD00216584

Customs Code

2933290090

FAQ

What is Methyl 1H-imidazole-4-carboxylate (CAS: 17325-26-7)?

Methyl 1H-imidazole-4-carboxylate (CAS: 17325-26-7) is an organic compound with the chemical formula C5H6N2O2. It is a derivative of imidazole, characterized by its basic nature and carboxylic acid functionality. This compound is commonly used in various applications due to its chemical stability and reactivity.

What are the main uses of Methyl 1H-imidazole-4-carboxylate (CAS: 17325-26-7)?

Methyl 1H-imidazole-4-carboxylate (CAS: 17325-26-7) is widely used in pharmaceuticals as an intermediate for the synthesis of antifungal and antiviral drugs. It is also utilized in the development of pesticides, herbicides, and fungicides. Additionally, it serves as a reagent in organic synthesis and as a component in certain industrial processes.

Is Methyl 1H-imidazole-4-carboxylate (CAS: 17325-26-7) safe?

Methyl 1H-imidazole-4-carboxylate (CAS: 17325-26-7) is generally safe when handled with appropriate precautions. It is important to follow safety guidelines, including wearing protective clothing and eyewear, and storing it in a cool, dry place away from direct sunlight. This compound is non-flammable but can react with strong oxidizers.

How should Methyl 1H-imidazole-4-carboxylate (CAS: 17325-26-7) be stored?

Methyl 1H-imidazole-4-carboxylate (CAS: 17325-26-7) should be stored in a cool, dry place, avoiding direct sunlight and high temperatures. It should be kept in a tightly sealed container to prevent degradation. Storage conditions should maintain a temperature below 25°C (77°F) and a relative humidity below 60% to ensure optimal stability.