2-(4-Isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-5-(methoxymethyl)nicotinic acid

Basic Information

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CAS Number

114311-32-9

Molecular Formula

C15H19N3O4

Molecular Weight

305.33 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

166-167 ºC

Density

1.31

Refractive Index

1.602

SMILES

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CC(C)C1(C(=O)NC(=N1)c2c(cc(cn2)COC)C(=O)O)C

InChI

InChI=1S/C15H19N3O4/c1-8(2)15(3)14(21)17-12(18-15)11-10(13(19)20)5-9(6-16-11)7-22-4/h5-6,8H,7H2,1-4H3,(H,19,20)(H,17,18,21)

InChIKey

NUPJIGQFXCQJBK-UHFFFAOYSA-N

LogP

1.2173

pKa

pK1 2.3; pK2 3.3(at 25℃)

Topological Polar Surface Area

100.88000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 7

Complexity

491

Safety Information

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GHS Hazard Pictograms

H410

Hazard Statement

H410 Very toxic to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class 9 Class 9

Toxicity

LD50 (technical grade) orally in rats: >5000 mg/kg; dermally in rabbits: >4000 mg/kg; LC50 by inhalation in rats: >6.3 mg/l (Glover)

Synonyms & References

English

Imazamox
2-(4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1h-imidazol-2-yl)-5-(methoxymethyl)-3-pyridinecarboxylic acid
(RS)-2-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-5-methoxymethylnicotinic acid
Odyseey
Raptor
Sweeper
Imazamox PESTANAL
AC299263
5-(methoxymethyl)-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyridine-3-carboxylic acid
Imazamox Solution
P-806N
(±)-Imazamox
+-5-methoxymethyl-2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-3-pyridinecarboxylic acid
2-[4,5-dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-(methoxymethyl)-3-pyridinecarboxylic acid
5-(methoxymethyl)-2-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)pyr
CL299263
Pulsar
rac-5-(methoxymethyl)-2-[(4R)-4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]pyridine-3-carboxylic acid
Raptor (herbicide)
RPTOR
KIAA1303
CL 299263
Imazamox 95% TC
CL29926
2-[4,5-Dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-(methoxymethyl)-3-pyridinecarboxylic acid
2-(4,5-Dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl)-5-(methoxymethyl)-3-pyridinecarboxylic acid
IMAZAMOX
2-(4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-5-(methoxymethyl)nicotinic acid

MDL Number

MFCD03427427

FAQ

What regulatory guidelines apply to 2-(4-Isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-5-(methoxymethyl)nicotinic acid (CAS: 114311-32-9)?

This compound falls under various regulatory guidelines including the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the European Union, and FDA and EPA requirements in the United States. It is essential to follow specific safety data sheets (SDS) for proper handling, storage, and disposal to ensure compliance with all relevant regulations.

Are there alternatives to 2-(4-Isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-5-(methoxymethyl)nicotinic acid (CAS: 114311-32-9) in synthesis?

Yes, there are alternative reagents and synthetic routes that can be used. For example, 4-methyl-4-isopropyl-3-oxo-3,4-dihydro-1H-imidazole and methoxyacetic acid can be used as starting materials. Additionally, isomers and analogs like 2-(4-tert-butyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-5-(methoxymethyl)nicotinic acid can also serve as viable alternatives.

What is the market or research trend for 2-(4-Isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-5-(methoxymethyl)nicotinic acid (CAS: 114311-32-9)?

The market for this compound is currently showing a steady growth trend, driven by increasing research in the pharmaceutical and biotechnology sectors. Recent studies indicate a growing interest in its potential applications in anti-inflammatory and antiviral therapies. Moreover, there is a significant trend towards developing more efficient and sustainable synthetic methods to produce this compound.

How should waste containing 2-(4-Isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-5-(methoxymethyl)nicotinic acid (CAS: 114311-32-9) be handled?

Waste containing this compound should be collected and disposed of in accordance with environmental protection regulations. It is recommended to use professional waste disposal services to ensure safe incineration or other appropriate methods. Proper safety measures, such as wearing protective gear and following local and international guidelines, should be strictly adhered to during the handling and disposal process.