2-Mercapto-5-trifluoromethoxybenzothiazole

Base Information

• Chemical Name: 2-Mercapto-5-trifluoromethoxybenzothiazole
• CAS No.: 155559-82-3
• Molecular Formula: C8H4F3NOS2
• Molecular Weight: 251.2486696
• Hs Code.: 2934200090
• DSSTox Substance ID: DTXSID90598567
• Wikidata: Q82494340
• Mol file: 155559-82-3.mol

Synonyms:155559-82-3;2-MERCAPTO-5-TRIFLUOROMETHOXYBENZOTHIAZOLE;5-(Trifluoromethoxy)benzo[d]thiazole-2-thiol;5-(Trifluoromethoxy)benzo[d]thiazole-2(3H)-thione;5-(trifluoromethoxy)-3H-1,3-benzothiazole-2-thione;C8H4F3NOS2;2(3H)-Benzothiazolethione, 5-(trifluoromethoxy)-;SCHEMBL9184354;DTXSID90598567;FDHNATDQODTQBI-UHFFFAOYSA-N;MFCD13195694;AKOS015856771;BS-21548;DB-347183;CS-0083378;E85603;A883641;5-(Trifluoromethoxy)-1,3-benzothiazole-2(3H)-thione;5-(TRIFLUOROMETHOXY)-1,3-BENZOTHIAZOLE-2-THIOL

Chemical Property of 2-Mercapto-5-trifluoromethoxybenzothiazole

Chemical Property:

• PSA: 89.16000
• LogP: 3.48360
• Storage Temp.: 2-8°C
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 250.96864058
• Heavy Atom Count: 15
• Complexity: 271

Purity/Quality:

NLT 98% ^*data from raw suppliers

2-Mercapto-5-trifluoromethoxybenzothiazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1OC(F)(F)F)NC(=S)S2