1H-1,2,4-triazol-5-amine
C2H4N4
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Identification
- CAS Number
- 61-82-5
- EC Number
- 200-521-5
- UN Number
- 3077
- Index Number
- 613-011-00-6
- PubChem CID
- 1639
Physical-chemical properties
- Molecular Formula
- C2H4N4
- Molar Mass
- 84.08 g/mol
- IUPAC Name
- 1H-1,2,4-triazol-5-amine
Chemical Identifiers
- InChI
- InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)
- InChI Key
- KLSJWNVTNUYHDU-UHFFFAOYSA-N
Overview
1H-1,2,4-triazol-5-amine (CAS 61-82-5) is a heterocyclic organic compound containing a triazole ring with an amino substituent at position 5. This nitrogen-rich heterocycle represents an important class of chemical intermediates widely utilized in pharmaceutical synthesis, agrochemical production, and specialty chemical manufacturing. The compound features a five-membered ring structure containing three nitrogen atoms and one primary amine group, conferring unique reactivity patterns that make it valuable for various synthetic applications. Its molecular formula C2H4N4 and molecular weight of 84.08 g/mol reflect its compact yet functionally dense structure. From a safety perspective, 1H-1,2,4-triazol-5-amine is classified with reproductive toxicity category 2 and specific target organ toxicity (repeated exposure) category 2, requiring careful handling protocols in industrial settings. The compound also presents aquatic chronic toxicity concerns, necessitating appropriate environmental protection measures during storage, handling, and disposal. These safety considerations are reflected in its GHS08 and GHS09 pictogram classifications and ADR class 9 designation for transportation purposes. The compound finds primary application in pharmaceutical intermediate synthesis, where its triazole scaffold serves as a building block for various therapeutic agents. It is also employed in agrochemical development, particularly in the synthesis of fungicidal compounds, where triazole derivatives demonstrate significant biological activity. Additionally, the compound serves as a precursor in specialty chemical synthesis, often in conjunction with related compounds such as propan-2-yl N-(3-chlorophenyl)carbamate in complex synthetic pathways. OYSI maintains reliable supply chains for 1H-1,2,4-triazol-5-amine to support European industrial customers' specialized chemical requirements.
Safety & Classification
Repr. 2; STOT RE 2 *; 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
Transport (ADR)
| UN Number | 3077 |
| ADR Class | 9 |
| Packing Group | III |
| Tunnel Code | - |
| Proper Shipping Name | Amitrol (ISO) |
| Marine Pollutant | No |
Frequently Asked Questions
What is 1H-1,2,4-triazol-5-amine?
1H-1,2,4-triazol-5-amine is a heterocyclic organic compound with the molecular formula C2H4N4 and CAS number 61-82-5. This triazole derivative features a five-membered ring containing three nitrogen atoms and an amino group. With a molecular weight of 84.08 g/mol, it serves as an important building block in pharmaceutical and agrochemical synthesis due to its nitrogen-rich structure and reactive amino functionality.
What are the physicochemical properties of 1H-1,2,4-triazol-5-amine?
1H-1,2,4-triazol-5-amine is typically a white to off-white crystalline solid at room temperature. The compound exhibits good water solubility due to its polar nitrogen atoms and amino group, making it readily soluble in polar solvents. It has a relatively low molecular weight of 84.08 g/mol and contains multiple nitrogen atoms, contributing to its basic character and potential for hydrogen bonding interactions.
What is 1H-1,2,4-triazol-5-amine used for?
1H-1,2,4-triazol-5-amine serves as a key intermediate in pharmaceutical synthesis, particularly for developing antifungal agents, anticonvulsants, and other therapeutic compounds. It is also utilized in agrochemical production for manufacturing pesticides and herbicides. Additionally, this compound finds applications in materials science as a building block for polymers, coordination complexes, and specialty chemicals requiring nitrogen-rich heterocyclic structures.
How to handle 1H-1,2,4-triazol-5-amine safely?
1H-1,2,4-triazol-5-amine requires careful handling due to its reproductive toxicity (Repr. 2) and potential for organ damage (STOT RE 2). Always wear appropriate personal protective equipment including safety goggles, chemical-resistant gloves, and protective clothing. Work in well-ventilated areas or under fume hoods to minimize inhalation exposure. Avoid skin contact and ingestion, and wash hands thoroughly after handling.
How to store 1H-1,2,4-triazol-5-amine correctly?
1H-1,2,4-triazol-5-amine should be stored in a cool, dry, well-ventilated area away from direct sunlight and heat sources. Keep containers tightly sealed to prevent moisture absorption and contamination. Store separately from incompatible materials such as strong oxidizing agents. Maintain storage temperatures below 25°C and ensure proper labeling with hazard warnings. Regular inventory checks should be conducted to monitor container integrity.
What to do in case of contact with 1H-1,2,4-triazol-5-amine?
In case of skin contact with 1H-1,2,4-triazol-5-amine, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. If eye contact occurs, flush immediately with clean water for 15-20 minutes. In case of inhalation, move to fresh air immediately. If ingested, do not induce vomiting and seek immediate medical attention, providing the safety data sheet to medical personnel.
How to dispose of 1H-1,2,4-triazol-5-amine properly?
1H-1,2,4-triazol-5-amine must be disposed of according to local, national, and international waste regulations due to its hazard classification. The compound should be treated as hazardous waste and collected by licensed waste disposal companies. Do not discharge into sewers, waterways, or soil due to its aquatic toxicity (Aquatic Chronic 2). Incineration at authorized facilities under controlled conditions is typically the preferred disposal method.
How to transport 1H-1,2,4-triazol-5-amine?
1H-1,2,4-triazol-5-amine is classified as ADR Class 9 (Miscellaneous dangerous substances), Packing Group III for transportation purposes. This classification requires appropriate packaging, labeling, and documentation during transport. Use UN-specification packaging and ensure proper hazard labeling including GHS08 and GHS09 pictograms. Transport vehicles must comply with ADR regulations, and drivers should carry appropriate emergency response information and safety data sheets.
Is 1H-1,2,4-triazol-5-amine subject to specific regulations?
1H-1,2,4-triazol-5-amine is subject to European REACH regulation requiring registration for manufacture or import above specified tonnages. The compound falls under CLP regulation with mandatory classification as Repr. 2, STOT RE 2, and Aquatic Chronic 2, requiring appropriate hazard labeling with Warning signal word. While not currently listed as SVHC, its reproductive toxicity classification means it requires careful regulatory compliance and risk assessment.
Where to buy 1H-1,2,4-triazol-5-amine in Europe?
1H-1,2,4-triazol-5-amine is available through OYSI, a specialized European distributor of technical chemicals serving industrial and research customers across Europe. OYSI provides comprehensive regulatory documentation, safety data sheets, and technical support to ensure compliant procurement and use. As a professional chemical supplier, OYSI maintains appropriate certifications and expertise to handle classified substances safely and efficiently throughout the European market.
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Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.