5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde

Basic Information

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CAS Number

660845-30-7

Molecular Formula

C6H5ClF2N2O

Molecular Weight

194.57 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

SMILES

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O=CC1=C(Cl)N(C)N=C1C(F)F

InChI

InChI=1S/C6H5ClF2N2O/c1-11-5(7)3(2-12)4(10-11)6(8)9/h2,6H,1H3

InChIKey

NMYPMEAFQUDCSC-UHFFFAOYSA-N

LogP

1.8236

Topological Polar Surface Area

34.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

181

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

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde
5-chloro-3-(difluoromethyl)-1-methylpyrazole-4-carbaldehyde
5-chloro-1-methyl-3-difluoromethyl-1H-pyrazole-4-carbaldehyde
5-chloro-3-difluoromethyl-1-methyl-1H-pyrazole-4-carboaldehyde
C-2406
1H-Pyrazole-4-carboxaldehyde, 5-chloro-3-(difluoromethyl)-1-methyl-
PubChem16989
NMYPMEAFQUDCSC-UHFFFAOYSA-N
SB18299
ST24044628
5-chloro-1-methyl-3-difluoromethyl-1H-pyrazole-4-carbald
5-chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde

MDL Number

MFCD12827692

Customs Code

2933199090

FAQ

What regulatory guidelines apply to 5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde (CAS: 660845-30-7)?

5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde (CAS: 660845-30-7) should adhere to the Globally Harmonized System (GHS) for classification and labeling of chemicals, REACH regulations in the European Union, and FDA/EPA guidelines for safe handling and disposal. Specific attention should be given to its classification as a hazardous substance based on its physical and chemical properties.

Are there alternatives to 5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde (CAS: 660845-30-7) in synthesis?

Alternatives to 5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde include similar pyrazole derivatives such as 5-bromopyrazoles, 3-(trifluoromethyl)pyrazoles, and related compounds. Common alternative reagents might involve using different chlorinating agents or substituents during the synthesis process.

What is the market or research trend for 5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde (CAS: 660845-30-7)?

The market and research trends for 5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde (CAS: 660845-30-7) are driven by its potential applications in pharmaceuticals and agrochemicals. Recent research focuses on its bioavailability and therapeutic potential, indicating a growing interest in exploring its role in drug discovery and development.

How should waste containing 5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde (CAS: 660845-30-7) be handled?

Waste containing 5-Chloro-3-(difluoromethyl)-1-methyl-1H-pyrazole-4-carbaldehyde should be collected in appropriate containers and handled with care to avoid spillage. Incineration or professional waste disposal services are recommended, ensuring that all safety and regulatory requirements are met. Proper handling and disposal help minimize environmental impact and ensure worker safety.