2-Chloro-4,6-dimethyl-1,3-benzothiazole

Base Information

• Chemical Name: 2-Chloro-4,6-dimethyl-1,3-benzothiazole
• CAS No.: 80689-35-6
• Molecular Formula: C₉H₈ClNS
• Molecular Weight: 197.688
• Hs Code.: 29342000
• DSSTox Substance ID: DTXSID80365962
• Wikidata: Q82151005
• Mol file: 80689-35-6.mol

Synonyms:80689-35-6;2-Chloro-4,6-dimethylbenzo[d]thiazole;2-chloro-4,6-dimethyl-1,3-benzothiazole;2-CHLORO-4,6-DIMETHYLBENZOTHIAZOLE;Benzothiazole, 2-chloro-4,6-dimethyl- (9CI);SCHEMBL11337728;DTXSID80365962;MFCD04971829;2-Chloro-4,6-Dimethyl-Benzothiazole;AKOS005208487;AC-27289;2-chloranyl-4,6-dimethyl-1,3-benzothiazole;FT-0688527;EN300-237731;F15173;A839965;F1910-0026

Chemical Property of 2-Chloro-4,6-dimethyl-1,3-benzothiazole

Chemical Property:

• Boiling Point: 287 °C at 760 mmHg
• Flash Point: 127.4 °C
• PSA: 41.13000
• Density: 1.311 g/cm³
• LogP: 3.56650
• Storage Temp.: 2-8°C
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 197.0065981
• Heavy Atom Count: 12
• Complexity: 176

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Chloro-4,6-dimethyl-1,3-benzothiazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C2C(=C1)SC(=N2)Cl)C