(1-Methyl-5-nitro-1H-imidazol-2-yl)methyl carbamate

Basic Information

View in Editor

CAS Number

7681-76-7

Molecular Formula

C6H8N4O4

Molecular Weight

200.15 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 Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

167-169°

Boiling Point

502.3°C at 760 mmHg

Density

1.5359 (rough estimate)

Flash Point

257.6°C

Refractive Index

1.6500 (estimate)

SMILES

View in Editor

CN1C(=CN=C1COC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C6H8N4O4/c1-9-4(3-14-6(7)11)8-2-5(9)10(12)13/h2H,3H2,1H3,(H2,7,11)

InChIKey

PQFRTXSWDXZRRS-UHFFFAOYSA-N

LogP

1.14710

pKa

1.2(at 25℃)

Complexity

241

Safety Information

View Safety Information

GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

HMS502O09
NCGC00021749-05
1-Methyl-5-nitroimidazole-2-methanol carbamate ester
NS00000699
SR-01000000287-2
RONIDAZOLE [USAN]
1-methyl-5-nitro-1H-imidazole-2-methanol carbamate ester
NCGC00016685-07
Ronidazole; (1-Methyl-5-nitro-imidazol-2-yl)methyl carbamate
(1-Methyl-5-nitro-1H-imidazol-2-yl)methyl carbamate
AS-10175
HMS1921L13
RONIDAZOLE (MART.)
HMS1571O12
(1-methyl-5-nitro-imidazol-2-yl)methyl carbamate
E01R4M1063
Spectrum4_000450
NCGC00016685-01
1-Methyl-5-nitro-1H-imidazole-2-methanol carbamate ester
KBio2_001627
Ronidazolum
KBio2_004195
NSC 757865
NCGC00016685-05
CHEBI:141154
MCMN
SPBio_003115
DTXCID4025400
Ronidazolum (INN-Latin)
CCG-40249
BSPBio_001250

MDL Number

MFCD00133801

FAQ

What is (1-Methyl-5-nitro-1H-imidazol-2-yl)methyl carbamate (CAS: 7681-76-7)?

It is a carbamate derivative with the chemical formula C6H7N3O3. This compound features a nitro group and a methyl substituent on the imidazole ring, making it a potent acetylcholinesterase inhibitor. It is typically a solid at room temperature, with moderate solubility in polar solvents. Its structure and reactivity make it relevant in pharmaceutical and agrochemical research.

What are the main uses of (1-Methyl-5-nitro-1H-imidazol-2-yl)methyl carbamate (CAS: 7681-76-7)?

Primarily used in pharmaceuticals as an insecticide and acaricide, this compound targets acetylcholinesterase enzymes. It also serves as a research tool for studying neurotoxicity and drug development. Applications include agricultural pest control and potential therapeutic exploration for neurological disorders.

Is (1-Methyl-5-nitro-1H-imidazol-2-yl)methyl carbamate (CAS: 7681-76-7) safe?

Safety depends on exposure levels and handling. It is toxic to humans and animals, with potential cholinesterase inhibition effects. Precautions include wearing gloves, goggles, and ensuring proper ventilation. Regulatory guidelines from OSHA and EPA emphasize safe use in controlled environments to minimize health risks.

How should (1-Methyl-5-nitro-1H-imidazol-2-yl)methyl carbamate (CAS: 7681-76-7) be stored?

Store at 2-8°C in airtight, moisture-proof containers. Keep away from light and heat sources to maintain stability. Avoid humid environments to prevent degradation. Use desiccants and ensure proper labeling for safe handling and long-term preservation.