Structure via PubChem · Public domain (PubChem)
۳-آمینو-۴،۲،۱-تریآزول
Sign in to saveAlso known as Amitrole, Aminotriazole, 3-Aminotriazole, 2-Amino-1,3,4-triazole, 3-Amino-1,2,4-triazole, 1H-1,2,4-Triazol-3-amine, 3,A-T, 3-Amino-1H-1,2,4-triazole
thumb|3-Amino-1,2,4-triazole in powder form 3-Amino-1,2,4-triazole (3-AT) is a heterocyclic organic compound that consists of 1,2,4-triazole with an amino group as a substituent.
Chemical data
- Formula
- C2H4N4
- Molecular weight
- 84.08 g/mol
- IUPAC name
- 1H-1,2,4-triazol-5-amine
- SMILES
- C1=NNC(=N1)N
- InChIKey
- KLSJWNVTNUYHDU-UHFFFAOYSA-N
- XLogP
- -0.4
- Polar surface area
- 67.6 Ų
- H-bond donors
- 2
- H-bond acceptors
- 3
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Research
11,495 papers- Amitrole.Report on carcinogens : carcinogen profiles · 2004
- Amitrole.IARC monographs on the evaluation of the carcinogenic risk of chemicals to humans · 1986
- Establishment and Characterization of Amitrole-Induced Mouse Thyroid Adenomatous Nodule-Derived Cell Lines.Thyroid : official journal of the American Thyroid Association · 2024
- Amitrole.Report on carcinogens : carcinogen profiles · 2011
- Amitrole.Report on carcinogens : carcinogen profiles · 2002
via PubMed
Wikidata facts
- Subclass of
- heterocyclic compound
- Mass
- 84.044
- Has use
- herbicide
Show 11 more facts
- melting point
- 318
- chemical formula
- C₂H₄N₄
- density
- 1.14
- NIOSH Pocket Guide ID
- 0027
- vapor pressure
- 0.000008
- solubility
- 28
- time-weighted average exposure limit
- 0.2
- median lethal dose (LD50)
- 1100
- canonical SMILES
- C1=NNC(=N1)N
- subject has role
- carcinogen
- Commons category
- 3-Amino-1,2,4-triazole
Sources (4)
via Wikidata · CC0