2-((5-Methyl-4-(naphthalen-1-yl)-4H-1,2,4-triazol-3-yl)thio)acetic acid

Base Information

• Chemical Name: 2-((5-Methyl-4-(naphthalen-1-yl)-4H-1,2,4-triazol-3-yl)thio)acetic acid
• CAS No.: 886498-52-8
• Molecular Formula: C15H13N3O2S
• Molecular Weight: 299.3
• Mol file: 886498-52-8.mol

Synonyms:886498-52-8;2-((5-Methyl-4-(naphthalen-1-yl)-4H-1,2,4-triazol-3-yl)thio)acetic acid;(5-Methyl-4-naphthalen-1-yl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid;2-[(5-methyl-4-naphthalen-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetic Acid;2-{[5-methyl-4-(naphthalen-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid;SCHEMBL10177198;AKOS005652705;2-((5-Methyl-4-(naphthalen-1-yl)-4H-1,2,4-triazol-3-yl)thio)aceticacid

Chemical Property of 2-((5-Methyl-4-(naphthalen-1-yl)-4H-1,2,4-triazol-3-yl)thio)acetic acid

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 299.07284784
• Heavy Atom Count: 21
• Complexity: 382

Purity/Quality:

2-((5-Methyl-4-(naphthalen-1-yl)-4H-1,2,4-triazol-3-yl)thio)aceticacid 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC1=NN=C(N1C2=CC=CC3=CC=CC=C32)SCC(=O)O