4-(3-Isocyanatophenyl)-2-methyl-1,3-thiazole

Base Information

• Chemical Name: 4-(3-Isocyanatophenyl)-2-methyl-1,3-thiazole
• CAS No.: 852180-41-7
• Molecular Formula: C11H8 N2 O S
• Molecular Weight: 216.263
• DSSTox Substance ID: DTXSID30406894
• Mol file: 852180-41-7.mol

Synonyms:4-(3-isocyanatophenyl)-2-methyl-1,3-thiazole;852180-41-7;Thiazole,4-(3-isocyanatophenyl)-2-methyl-;4-(3-isocyanatophenyl)-2-methylthiazole;SCHEMBL61464;DTXSID30406894;FGXXZVGMPBZEBB-UHFFFAOYSA-N;MFCD07368504;FT-0737609;EN300-149855;J-513393

Chemical Property of 4-(3-Isocyanatophenyl)-2-methyl-1,3-thiazole

Chemical Property:

• Vapor Pressure: 1.59E-05mmHg at 25°C
• Refractive Index: 1.645
• Boiling Point: 365.2°C at 760 mmHg
• Flash Point: 174.7°C
• PSA: 70.56000
• Density: 1.25g/cm³
• LogP: 3.08580
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 216.03573406
• Heavy Atom Count: 15
• Complexity: 265

Purity/Quality:

98% ^*data from raw suppliers

4-(3-ISOCYANATOPHENYL)-2-METHYL-1,3-THIAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(=CS1)C2=CC(=CC=C2)N=C=O