2-Fluoro-4,5-dimethoxybenzonitrile

Base Information

• Chemical Name: 2-Fluoro-4,5-dimethoxybenzonitrile
• CAS No.: 119396-88-2
• Molecular Formula: C₉H₈FNO₂
• Molecular Weight: 181.166
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID50378963
• Nikkaji Number: J868.792G
• Wikidata: Q82168573
• Mol file: 119396-88-2.mol

Synonyms:2-fluoro-4,5-dimethoxybenzonitrile;119396-88-2;4,5-Dimethoxy-2-fluorobenzonitrile;Benzonitrile, 2-fluoro-4,5-dimethoxy-;4-Cyano-5-fluoroveratrole;SCHEMBL10537256;DTXSID50378963;CL9706;MFCD00143236;AKOS006228582;PS-8532;F0641;FT-0659686;2-fluoranyl-4,5-dimethoxy-benzenecarbonitrile;EN300-6504644;A804275;Z1201619307

Chemical Property of 2-Fluoro-4,5-dimethoxybenzonitrile

Chemical Property:

• Vapor Pressure: 0.0105mmHg at 25°C
• Melting Point: 143 °C
• Refractive Index: 1.501
• Boiling Point: 263.1 °C at 760 mmHg
• Flash Point: 112.9 °C
• PSA: 42.25000
• Density: 1.2 g/cm³
• LogP: 1.71458
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 181.05390666
• Heavy Atom Count: 13
• Complexity: 213

Purity/Quality:

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

4,5-Dimethoxy-2-fluorobenzonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C(=C1)C#N)F)OC