4-Methyl-1,3-benzothiazole-2,6-diamine

Base Information

• Chemical Name: 4-Methyl-1,3-benzothiazole-2,6-diamine
• CAS No.: 314033-52-8
• Molecular Formula: C8H9N3S
• Molecular Weight: 179.24
• Hs Code.: 2934200090
• DSSTox Substance ID: DTXSID60354314
• Wikidata: Q82132377
• Mol file: 314033-52-8.mol

Synonyms:4-methyl-1,3-benzothiazole-2,6-diamine;314033-52-8;4-Methylbenzo[d]thiazole-2,6-diamine;Oprea1_501533;Oprea1_709508;SCHEMBL5247755;DTXSID60354314;MFCD00616531;AKOS000299555

Chemical Property of 4-Methyl-1,3-benzothiazole-2,6-diamine

Chemical Property:

• Boiling Point: 407.2±37.0 °C(Predicted)
• PKA: 6.33±0.10(Predicted)
• PSA: 93.90000
• Density: 1.410±0.06 g/cm3(Predicted)
• LogP: 2.28040
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 179.05171847
• Heavy Atom Count: 12
• Complexity: 176

Purity/Quality:

97% ^*data from raw suppliers

4-Methyl-1,3-benzothiazole-2,6-diamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC2=C1N=C(S2)N)N