2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol
C14H17Cl2N3O
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Identification
- CAS Number
- 79983-71-4
- EC Number
- 413-050-7
- UN Number
- 3077
- Index Number
- 613-171-00-7
- PubChem CID
- 66461
Physical-chemical properties
- Molecular Formula
- C14H17Cl2N3O
- Molar Mass
- 314.20 g/mol
- IUPAC Name
- 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol
Chemical Identifiers
- InChI
- InChI=1S/C14H17Cl2N3O/c1-2-3-6-14(20,8-19-10-17-9-18-19)12-5-4-11(15)7-13(12)16/h4-5,7,9-10,20H,2-3,6,8H2,1H3
- InChI Key
- STMIIPIFODONDC-UHFFFAOYSA-N
Overview
2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol (CAS 79983-71-4) is a triazole-containing organic compound with antifungal properties and industrial applications. This synthetic organic molecule belongs to the triazole family of compounds, characterized by its distinctive molecular structure combining a dichlorophenyl group with a triazole ring system. With the molecular formula C14H17Cl2N3O and a molecular weight of 314.2 g/mol, this compound exhibits both aromatic and heterocyclic features that contribute to its chemical stability and biological activity. The compound's safety profile requires careful handling, as indicated by its classification under Acute Toxicity Category 4, Skin Sensitization Category 1, and Aquatic Chronic Toxicity Category 2. The presence of GHS07 and GHS09 pictograms emphasizes the need for appropriate personal protective equipment and environmental precautions during use. Its ADR Class 9 classification further confirms its status as a miscellaneous dangerous substance requiring specialized transport conditions. The triazole structure of this compound places it in a similar chemical category to other specialized industrial chemicals such as 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one, which shares the characteristic triazole functionality. This structural similarity often translates to comparable applications in industrial processes. Primary industrial applications include its use as an antifungal agent in agricultural formulations, as an intermediate in pharmaceutical synthesis, and as a specialized chemical reagent in organic synthesis processes. The compound's unique molecular architecture makes it particularly valuable in applications requiring both antimicrobial properties and chemical stability. OYSI maintains reliable supply chains for this specialized chemical compound, ensuring consistent availability for European industrial customers requiring high-quality triazole derivatives.
Safety & Classification
Acute Tox. 4 *; Skin Sens. 1; Aquatic Chronic 2
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
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
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:
Ingestion
Measures if substance is accidentally swallowed
First Aid Actions
- +P301IF SWALLOWED:
- +P330Rinse mouth.
- +P331Do NOT induce vomiting.
- +P310Immediately call a POISON CENTER/doctor.
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 Number | 3077 |
| ADR Class | 9 |
| Packing Group | III |
| Tunnel Code | - |
| Proper Shipping Name | Hexaconazol (ISO) |
| Marine Pollutant | No |
Frequently Asked Questions
What is 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol?
2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol is an organochlorine compound with antifungal properties, identified by CAS number 79983-71-4. This chemical substance has the molecular formula C14H17Cl2N3O and a molecular weight of 314.2 g/mol. It belongs to the triazole family and contains both dichlorophenyl and triazole functional groups, making it effective against various fungal pathogens.
What are the physicochemical properties of 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol?
2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol is typically a white to off-white crystalline solid at room temperature. The compound has a molecular weight of 314.2 g/mol and contains chlorine atoms which contribute to its stability. Its triazole structure provides good thermal stability, while the hydroxyl group influences its solubility characteristics. The presence of aromatic rings affects its melting point and overall physical behavior.
What is 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol used for?
2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol is primarily used as an antifungal agent in agricultural and industrial applications. Its triazole structure makes it effective against a broad spectrum of fungal diseases in crops and plants. The compound may also serve as an intermediate in the synthesis of other fungicides or pharmaceutical compounds, contributing to the development of plant protection products and specialty chemicals.
How to handle 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol safely?
Safe handling of 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol requires appropriate personal protective equipment including gloves, safety goggles, and protective clothing. Work in well-ventilated areas to minimize inhalation exposure. Avoid direct skin contact as the substance is classified as a skin sensitizer. Use proper dust control measures when handling the solid form, and ensure emergency shower and eyewash facilities are readily accessible.
How to store 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol correctly?
Proper storage of 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol requires a cool, dry, well-ventilated area away from direct sunlight and heat sources. Store in tightly closed original containers to prevent moisture absorption and contamination. Keep away from incompatible materials such as strong oxidizing agents and bases. Maintain storage temperature below 25°C and ensure adequate separation from foodstuffs and animal feed.
What to do in case of contact with 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol?
Immediate first aid for skin contact with 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol involves removing contaminated clothing and washing the affected area thoroughly with soap and water for at least 15 minutes. For eye contact, rinse immediately with clean water for 15-20 minutes. If inhaled, move the person to fresh air. Seek medical attention if symptoms develop or persist, especially considering the substance's skin sensitizing properties.
How to dispose of 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol appropriately?
Disposal of 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol must comply with local and national hazardous waste regulations. This substance requires treatment as hazardous waste due to its classification and environmental impact potential. Contact licensed waste disposal companies for proper collection and treatment. Never dispose of this chemical through regular waste streams or sewage systems, as it poses risks to aquatic environments and requires specialized handling.
How to transport 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol?
Transportation of 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol falls under ADR Class 9 (Miscellaneous dangerous substances), Packing Group III. This classification indicates it presents a relatively lower but still significant transport hazard. Packages must be properly labeled with appropriate hazard markings and transported according to dangerous goods regulations. Ensure proper documentation accompanies shipments and use approved packaging that meets UN specification requirements.
Is 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol subject to specific regulations?
2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol is subject to REACH regulation in Europe and must comply with CLP classification requirements. The substance is classified with GHS07 and GHS09 pictograms, indicating health and environmental hazards. While not currently listed as a Substance of Very High Concern (SVHC), it requires proper registration, safety data sheets, and hazard communication throughout the supply chain.
Where to buy 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol in Europe?
OYSI serves as a reliable European distributor for 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol, offering this specialty chemical to industrial and research customers across Europe. As an established chemical distributor, OYSI ensures proper handling, documentation, and regulatory compliance for this substance. Contact OYSI directly for availability, technical specifications, and pricing information tailored to your specific requirements and application needs.
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ADR Consulting for 2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol
2-(2,4-dichlorophenyl)-1-(1,2,4-triazol-1-yl)hexan-2-ol is a dangerous good. We support you with labeling, packaging, and transport documentation.
Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.