2-Butyl-4-methylthiazole

Base Information

• Chemical Name: 2-Butyl-4-methylthiazole
• CAS No.: 76572-47-9
• Molecular Formula: C8H13 N S
• Molecular Weight: 155.26
• DSSTox Substance ID: DTXSID501313435
• Nikkaji Number: J45.633K
• Wikidata: Q63408746
• Metabolomics Workbench ID: 48833
• Mol file: 76572-47-9.mol

Synonyms:2-Butyl-4-methylthiazole;2-n-Butyl-4-methylthiazole;2-Butyl-4-methyl-1,3-thiazole;76572-47-9;Thiazole, 2-butyl-4-methyl-;2-Butyl-4-methyl-Thiazole;SCHEMBL11570650;DTXSID501313435;2-Butyl-4-methyl-1,3-thiazole #;AKOS026732169;Q63408746

Chemical Property of 2-Butyl-4-methylthiazole

Chemical Property:

• Boiling Point: 214.8±9.0 °C(Predicted)
• PKA: 3.72±0.10(Predicted)
• PSA: 41.13000
• Density: 1.006±0.06 g/cm3(Predicted)
• LogP: 2.79410
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 155.07687059
• Heavy Atom Count: 10
• Complexity: 95.3

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC1=NC(=CS1)C