4-Amino-4H-1,2,4-triazole

4-Amino-4H-1,2,4-triazole
  • CAS No.:584-13-4
Other grades of this product :
4-Amino-4H-1,2,4-triazole Basic information
Product Name:4-Amino-4H-1,2,4-triazole
Synonyms:4-AMINO-1,2,4-TRIAZOLE FOR SYNTHESIS;METHYL P-BROMOPHENYL KETONE;4H-1,2,4-TRIAZOL-4-AMINE;4-AMINO-1,2,4-TRIAZOLE;4-AMINO-4H-1,2,4-TRIAZOLE;4-AMino-1;1-Amino-1H-1,3,4-triazole;4H-1,2,4-Triazole, 4-amino- (8CI)
CAS:584-13-4
MF:C2H4N4
MW:84.08
EINECS:209-533-5
Product Categories:Amination;Heterocyclic Compounds;Heterocycles;Building Blocks;Chemical Synthesis;Heterocyclic Building Blocks;Synthetic Organic Chemistry;Triazoles;bc0001
Mol File:584-13-4.mol
4-Amino-4H-1,2,4-triazole Chemical Properties
Melting point 84-86 °C(lit.)
Boiling point 255 °C(lit.)
density 1.59±0.1 g/cm3(Predicted)
refractive index 1.7390 (estimate)
Fp >230 °F
storage temp. Store below +30°C.
solubility methanol: 0.1 g/mL, clear
form Crystalline Powder
pka3.20±0.10(Predicted)
color White to off-white or beige
PH<7 (H2O, 20℃)
Water Solubility 810 g/L (20 ºC)
BRN 107563
InChIKeyFMCUPJKTGNBGEC-UHFFFAOYSA-N
CAS DataBase Reference584-13-4(CAS DataBase Reference)
EPA Substance Registry System4-Amino-1,2,4-triazole (584-13-4)
Safety Information
Hazard Codes Xn,Xi
Risk Statements 36/37/38-42/43
Safety Statements 26-36
WGK Germany 3
RTECS XZ3850200
8
Hazard Note Irritant
HS Code 2933 99 80
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
ALFA English
4-Amino-4H-1,2,4-triazole Usage And Synthesis
Chemical Propertieswhite to off-white or beige crystalline powder
Uses1,2,4-Triazol-4-amine is an intermediate used to prepare potent, selective, and orally active cyclooxygenase-?2 inhibitors. It is also used to synthesize hydroxyphenacyl azoles and related azolium derivatives as antifungal agents.
Purification MethodsIt crystallises from EtOH/ Et2O or H2O. The hydrochloride has m 151-152o (from EtOH, 1g/10mL). [Allen & Bell Org Synth Coll Vol III 96 1955, Barszez et al. J Chem Soc, Dalton Trans 2025 1986, Beilstein 26 H 16, 26 II 7, 26 III/IV 40, Temple & Montgomery 1,2,4-Triazoles —The Chemistry of Heterocyclic Compounds Vol 37 (Weissberger & Taylor eds.). Wiley & Sons NY 1981, ISBN 0-471-0656-6.]
4-Amino-4H-1,2,4-triazole Preparation Products And Raw materials
Raw materialsEthanol-->Formylhydrazine
Preparation Products4-(4-BROMOPHENYL)-3-PYRIDINECARBOXALDEHYDE-->1-(4-Nitrophenyl)methyl-1,2,4-triazole

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