5-(Benzylsulfonyl)-1H-1,2,4-triazole-1-methanol

Base Information

• Chemical Name: 5-(Benzylsulfonyl)-1H-1,2,4-triazole-1-methanol
• CAS No.: 32550-64-4
• Molecular Formula: C10H11N3O3S
• Molecular Weight: 253.28
• DSSTox Substance ID: DTXSID30954289
• Nikkaji Number: J91.079A
• Mol file: 32550-64-4.mol

Synonyms:32550-64-4;5-(Benzylsulfonyl)-1H-1,2,4-triazole-1-methanol;1H-1,2,4-Triazole-1-methanol, 5-(benzylsulfonyl)-;(5-(Benzylsulfonyl)-1H-1,2,4-triazol-1-yl)methanol;DTXSID30954289;LS-156026;[5-(Phenylmethanesulfonyl)-1H-1,2,4-triazol-1-yl]methanol

Chemical Property of 5-(Benzylsulfonyl)-1H-1,2,4-triazole-1-methanol

Chemical Property:

• Vapor Pressure: 2.66E-11mmHg at 25°C
• Boiling Point: 511.9°C at 760 mmHg
• Flash Point: 263.4°C
• PSA: 0.00000
• Density: 1.45g/cm³
• LogP: 0.00000
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 253.05211239
• Heavy Atom Count: 17
• Complexity: 335

Purity/Quality:

5-(BENZYLSULFONYL)-1H-1,2,4-TRIAZOLE-1-METHANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CS(=O)(=O)C2=NC=NN2CO