4-Fluoro-3-methylphenylacetonitrile

Base Information

• Chemical Name: 4-Fluoro-3-methylphenylacetonitrile
• CAS No.: 1000548-41-3
• Molecular Formula: C₉H₈FN
• Molecular Weight: 149.168
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID40602587
• Wikidata: Q82499715
• Mol file: 1000548-41-3.mol

Synonyms:1000548-41-3;4-FLUORO-3-METHYLPHENYLACETONITRILE;4-Fluoro-3-methylbenzyl cyanide;2-(4-fluoro-3-methylphenyl)acetonitrile;(4-Fluoro-3-methylphenyl)acetonitrile;SCHEMBL909509;DTXSID40602587;XAVNYICMRHFCLO-UHFFFAOYSA-N;4-Floro-3-methylphenylacetonitrile;MFCD09832240;AKOS006328947;AS-40436;DA-39398;CS-0061265;EN300-1841036

Chemical Property of 4-Fluoro-3-methylphenylacetonitrile

Chemical Property:

• PSA: 23.79000
• LogP: 2.20018
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 149.064077422
• Heavy Atom Count: 11
• Complexity: 170

Purity/Quality:

99% ^*data from raw suppliers

4-Fluoro-3-methylbenzylCyanide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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