7-Benzothiazolesulfonic acid, 6-methyl-2-(2-methyl-6-quinolinyl)-

Base Information

• Chemical Name: 7-Benzothiazolesulfonic acid, 6-methyl-2-(2-methyl-6-quinolinyl)-
• CAS No.: 3181-86-0
• Molecular Formula: C18H14 N2 O3 S2
• Molecular Weight: 370.44536
• European Community (EC) Number: 221-670-2
• DSSTox Substance ID: DTXSID5062899
• Nikkaji Number: J262.301C
• Wikidata: Q81990337
• Mol file: 3181-86-0.mol

Synonyms:3181-86-0;7-Benzothiazolesulfonic acid, 6-methyl-2-(2-methyl-6-quinolinyl)-;EINECS 221-670-2;7-Benzothiazolesulfonic acid, 6-methyl-2-(2-methyl-6-quinolyl)-;C18H14N2O3S2;6-Methyl-2-(2-methyl-6-quinolyl)benzothiazole-7-sulphonic acid;6-Methyl-2-(2-methylquinolin-6-yl)benzo[d]thiazole-7-sulfonic acid;6-methyl-2-(2-methylquinolin-6-yl)-1,3-benzothiazole-7-sulfonic acid;DTXSID5062899;6-Methyl-2-(2-methyl-6-quinolinyl)-7-benzothiazolesulfonic acid

Chemical Property of 7-Benzothiazolesulfonic acid, 6-methyl-2-(2-methyl-6-quinolinyl)-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 116.77000
• Density: 1.457g/cm³
• LogP: 5.45580
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 370.04458466
• Heavy Atom Count: 25
• Complexity: 594

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C)S(=O)(=O)O