2-Fluoro-4-methylphenyl isothiocyanate

Base Information

• Chemical Name: 2-Fluoro-4-methylphenyl isothiocyanate
• CAS No.: 864350-17-4
• Molecular Formula: C8H6FNS
• Molecular Weight: 167.20300
• Hs Code.: 2930909090
• European Community (EC) Number: 674-648-3
• DSSTox Substance ID: DTXSID80374610
• Mol file: 864350-17-4.mol

Synonyms:2-Fluoro-4-methylphenyl isothiocyanate;864350-17-4;2-fluoro-1-isothiocyanato-4-methylbenzene;SCHEMBL348654;DTXSID80374610;YIAWVEYKLJFZBS-UHFFFAOYSA-N;2-Fluoro-4-methylphenylisothiocyanate;AKOS002675890;FT-0691672

Chemical Property of 2-Fluoro-4-methylphenyl isothiocyanate

Chemical Property:

• PSA: 44.45000
• LogP: 2.86840
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 167.02049853
• Heavy Atom Count: 11
• Complexity: 177

Purity/Quality:

98%min ^*data from raw suppliers

2-FLUORO-4-METHYLPHENYL ISOTHIOCYANATE 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)N=C=S)F