4-(1H-1,2,4-Triazol-1-ylmethyl)Benzoic Acid

• CAS: 160388-54-5
• Catalog Number: ACM160388545
• Category: Other Products
• Molecular Weight: 203.20g/mol
• Molecular Formula: C10H9N3O2
• Synonyms: 4-[1,2,4]TRIAZOL-1-YLMETHYL-BENZOIC ACID;4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZOIC ACID;4-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid hydrochloride;benzoic acid, 4-(1H-1,2,4-triazol-1-ylmethyl)-
• IUPAC Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid
• InChI: InChI=1S/C10H9N3O2/c14-10(15)9-3-1-8(2-4-9)5-13-7-11-6-12-13/h1-4,6-7H,5H2,(H,14,15)
• InChI Key: DJXUEFGFCMIONN-UHFFFAOYSA-N
• Complexity: 227
• CompoundIs Canonicalized: Yes
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Exact Mass: 203.069476538g/mol
• Formal Charge: 0
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Isotope Atom Count: 0
• Monoisotopic Mass: 203.069476538g/mol
• Rotatable Bond Count: 3
• Topological Polar Surface Area: 68Ų
• Undefined Atom Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• XLogP3: 0.4

Custom Reviews

June 16, 2023

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High quality materials
4-(1H-1,2,4-Triazol-1-ylmethyl)benzoic acid has high quality and purity, and the synthesized electronic materials are easy to use.

Synthetic Use

Upstream Synthesis Route 1

• 160388-64-7

• 160388-54-5

Reference: [1]Il Farmaco,1994,vol. 49,p. 625 - 632

Upstream Synthesis Route 2

• 26496-94-6

• 160388-54-5

Reference: [1]Il Farmaco,1994,vol. 49,p. 625 - 632