2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide

C14H16ClN3O

CAS67129-08-2
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
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Identification

CAS Number
67129-08-2
EC Number
266-583-0
UN Number
3077
Index Number
616-205-00-9
PubChem CID
49384

Physical-chemical properties

Molecular Formula
C14H16ClN3O
Molar Mass
277.75 g/mol
IUPAC Name
2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide

Chemical Identifiers

InChI
InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3
InChI Key
STEPQTYSZVCJPV-UHFFFAOYSA-N

Overview

2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide (CAS 67129-08-2) is a specialized chlorinated amide compound with distinctive pyrazole and dimethylphenyl structural features. This technical chemical compound represents a complex organic molecule combining multiple functional groups including a chloroacetamide backbone, a substituted aromatic ring system, and a pyrazole heterocycle. With its molecular formula C14H16ClN3O and molecular weight of 277.75 g/mol, this substance exhibits unique chemical properties that make it valuable for specific industrial applications. The compound's structure incorporates a 2,6-dimethylphenyl group linked through an amide nitrogen to both a chloroacetyl moiety and a pyrazol-1-ylmethyl substituent. From a safety perspective, this substance requires careful handling due to its classification as a Category 2 carcinogen and Category 1B skin sensitizer under GHS regulations. The compound also presents significant environmental concerns, classified as Aquatic Acute 1 and Aquatic Chronic 1, indicating high toxicity to aquatic organisms with long-lasting effects. Transportation falls under ADR Class 9 miscellaneous dangerous goods, reflecting its specialized handling requirements. Industrial applications typically involve its use as an intermediate in pharmaceutical synthesis and agricultural chemical production. The compound's unique structural features make it particularly valuable in developing specialized active ingredients where the combination of aromatic substitution patterns and heterocyclic functionality is required. Its chemical similarity to other complex organic intermediates like 6-amino-N-methylnaphthalene-2-sulfonamide demonstrates its role in advanced chemical manufacturing processes. OYSI maintains technical-grade supplies of this specialized chemical intermediate for qualified industrial customers across European markets.

Safety & Classification

Warning
Classification:

Carc. 2; Skin Sens. 1B; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H351

Suspected of causing cancer.

H317

May cause an allergic skin reaction.

H400

Very toxic to aquatic life.

H410

Very toxic to aquatic life with long lasting effects.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Skin Contact

Irritant

Measures if substance contacts the skin

First Aid Actions

  • +P302IF ON SKIN:
  • +P352Wash with plenty of water.
  • +P361Take off immediately all contaminated clothing.
  • +P313Get medical advice/attention.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number3077
ADR Class9
Packing GroupIII
Tunnel Code-
Proper Shipping NameMetazachlor (ISO)
Marine PollutantNo

Frequently Asked Questions

What is 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide?

2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide is an organic chemical compound with the molecular formula C14H16ClN3O and CAS number 67129-08-2. This chlorinated acetamide derivative has a molecular weight of 277.75 g/mol and contains both aromatic and heterocyclic structural elements. The compound is classified as hazardous with potential carcinogenic properties (Category 2) and skin sensitizing effects (Category 1B). It also presents significant environmental risks to aquatic ecosystems.

What are the physicochemical properties of 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide?

2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide is a solid organic compound at room temperature with a molecular weight of 277.75 g/mol. The compound contains chlorine, nitrogen, and oxygen atoms within its aromatic and heterocyclic structure. Its solubility characteristics depend on the solvent polarity, with organic solvents typically providing better dissolution than water. The presence of both polar and non-polar functional groups influences its physical behavior and chemical reactivity.

What is 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide used for?

2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide is primarily used as an intermediate in chemical synthesis and pharmaceutical research applications. Its unique molecular structure makes it valuable for developing specialized compounds in laboratory settings. The presence of reactive functional groups allows for further chemical modifications and derivatization. Due to its hazardous classification, its use is restricted to professional industrial applications with appropriate safety measures and regulatory compliance.

How to handle 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide safely?

Safe handling of 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide requires appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing to prevent skin contact. Work should be conducted in well-ventilated areas or under fume hoods to avoid inhalation. Given its skin sensitizing properties and potential carcinogenic effects, minimize exposure time and use proper handling techniques. Always wash hands thoroughly after handling and follow workplace safety protocols for hazardous substances.

How to store 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide correctly?

2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from heat sources and direct sunlight. Keep containers upright and secure to prevent spills. Store separately from incompatible materials and ensure proper labeling with hazard information. Access should be restricted to authorized personnel only, and storage areas must comply with local regulations for hazardous substances. Regular inspection of containers for integrity is recommended.

What to do in case of contact with 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide?

In case of skin contact with 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. For eye contact, rinse immediately with clean water for 15 minutes while holding eyelids open. If inhaled, move to fresh air immediately. Remove from exposure and seek medical attention promptly, especially given the compound's sensitizing and potentially carcinogenic properties. Never induce vomiting if ingested.

How to dispose of 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide appropriately?

Disposal of 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide must be conducted through licensed hazardous waste disposal facilities in accordance with local and national environmental regulations. The compound cannot be disposed of through regular waste streams due to its hazardous classification and environmental toxicity to aquatic organisms. Contact certified waste management companies for proper collection, treatment, and disposal. Maintain detailed records of waste disposal for regulatory compliance and environmental responsibility.

How to transport 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide?

2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide is classified as ADR Class 9 (Miscellaneous Dangerous Substances), Packing Group III for transportation purposes. This classification requires appropriate packaging, labeling, and documentation according to international dangerous goods regulations. Shipments must use UN-approved packaging with proper hazard markings and transport documents. Only qualified carriers with dangerous goods certification should handle transportation. Ensure compliance with national and international transport regulations for hazardous materials.

Is 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide subject to specific regulations?

2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide is subject to various chemical regulations including REACH registration requirements in Europe and CLP classification for hazard communication. The compound's hazardous properties require compliance with workplace safety standards, environmental protection laws, and proper labeling with GHS pictograms (GHS07, GHS08, GHS09) and warning signals. While not currently listed as a SVHC (Substance of Very High Concern), its carcinogenic and environmental classifications necessitate strict regulatory adherence.

Where to buy 2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide in Europe?

2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides this compound to qualified industrial and research customers with proper documentation and safety data sheets. As a regulated hazardous substance, purchases require verification of intended use and appropriate handling capabilities. Contact OYSI directly for availability, specifications, and regulatory compliance support to ensure proper procurement and handling of this specialized chemical compound.

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2-chloro-N-(2,6-dimethylphenyl)-N-(pyrazol-1-ylmethyl)acetamide is a dangerous good. We support you with labeling, packaging, and transport documentation.

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Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.