5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol

Base Information

• Chemical Name: 5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol
• CAS No.: 447412-27-3
• Molecular Formula: C11H12ClN3OS
• Molecular Weight: 269.75
• DSSTox Substance ID: DTXSID401129390
• Mol file: 447412-27-3.mol

Synonyms:5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol;447412-27-3;3-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-1H-1,2,4-triazole-5-thione;5-((4-Chloro-3-methylphenoxy)methyl)-4-methyl-4H-1,2,4-triazole-3-thiol;DTXSID401129390;CCG-26030;MFCD02934387;STK130200;AKOS001755638;NCGC00332283-01;LS-01269;CS-0323124;EU-0086225;AB00304632-03;AG-205/40776293;SR-01000534935;SR-01000534935-1;5-(4-Chloro-3-methyl-phenoxymethyl)-4-methyl-4H-[1,2,4]triazole-3-thiol;5-[(4-Chloro-3-methylphenoxy)methyl]-2,4-dihydro-4-methyl-3H-1,2,4-triazole-3-thione;5-[(4-Chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-yl hydrosulfide #;5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazol-3-ylhydrosulfide

Chemical Property of 5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 269.0389609
• Heavy Atom Count: 17
• Complexity: 337

Purity/Quality:

98%min ^*data from raw suppliers

5-[(4-Chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole-3-thiol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)OCC2=NNC(=S)N2C)Cl