CAS 252742-72-6: 3-Chloromethyl-1,2,4-triazolin-5-one

Description: 3-Chloromethyl-1,2,4-triazolin-5-one is a heterocyclic compound characterized by its triazole ring structure, which contains nitrogen atoms that contribute to its reactivity and potential biological activity. This compound features a chloromethyl group, which enhances its electrophilic properties, making it useful in various chemical reactions, including nucleophilic substitutions. The presence of the triazolinone moiety suggests potential applications in pharmaceuticals, agrochemicals, or as a building block in organic synthesis. Its molecular structure allows for interactions with biological targets, which may lead to antimicrobial or herbicidal properties. The compound's stability and solubility can vary depending on the solvent and environmental conditions, influencing its practical applications. Safety data and handling precautions are essential due to the presence of chlorine, which can pose health risks. Overall, 3-Chloromethyl-1,2,4-triazolin-5-one is a versatile compound with significant potential in various fields of chemistry and material science.

Formula: C₃H₄ClN₃O

InChI: InChI=1S/C3H4ClN3O/c4-1-2-5-3(8)7-6-2/h1H2,(H2,5,6,7,8)

InChI key: InChIKey=ZLRBJVJEQXBAAI-UHFFFAOYSA-N

SMILES: O=C1NN=C(N1)CCl

Synonyms:

• 3H-1,2,4-Triazol-3-one, 5-(chloromethyl)-1,2-dihydro-
• 5-(Chloromethyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
• 5-(chloromethyl)-1,2-dihydro-3H-1,2,4-triazol-3-one
• 5-Chloromethyl-2,3-dihydro-4H-1,2,4-triazol-3-one
• 5-Chloromethyl-2,4-dihydro-[1,2,4]triazol-3-one
• 5-Chloromethyl-2H-1,2,4-triazolin-3-one
• 3-Chloromethyl-1,2,4-triazolin-5-one

3H-1,2,4-Triazol-3-one, 5-(chloromethyl)-1,2-dihydro-

CAS: 252742-72-6

• Formula: C₃H₄ClN₃O
• Purity: 97%
• Color and Shape: Solid
• Molecular weight: 133.53636

5-Chloromethyl-2,4-dihydro-[1,2,4]triazol-3-one

CAS: 252742-72-6

• Purity: 98+%
• Color and Shape: White Solid
• Molecular weight: 133.54g/mol

3-(Chloromethyl)-1H-1,2,4-triazol-5(4H)-one

CAS: 252742-72-6

• Purity: 97.0%
• Color and Shape: Solid
• Molecular weight: 133.5399932861328

5-Chloromethyl-2H-1,2,4-triazolin-3-one

CAS: 252742-72-6

Applications 5-Chloromethyl-2H-1,2,4-triazolin-3-one, is an intermediate used in the synthesis of Aprepitant (A729800) and Fosaprepitant, used …

• Formula: C₃H₄ClN₃O
• Color and Shape: Neat
• Molecular weight: 133.54

3-(Chloromethyl)-1H-1,2,4-triazol-5(4H)-one

CAS: 252742-72-6

Please enquire for more information about 3-(Chloromethyl)-1H-1,2,4-triazol-5(4H)-one including the price, delivery time and more detailed …

• Formula: C₃H₄CIN₃O
• Purity: Min. 95%
• Molecular weight: 237 g/mol