3,5-Difluoro-2-methoxybenzonitrile

Base Information

• Chemical Name: 3,5-Difluoro-2-methoxybenzonitrile
• CAS No.: 874804-08-7
• Molecular Formula: C8H5 F2 N O
• Molecular Weight: 169.13
• Hs Code.: 2926909090
• European Community (EC) Number: 642-730-8
• DSSTox Substance ID: DTXSID901296097
• Wikidata: Q106902689
• Mol file: 874804-08-7.mol

Synonyms:3,5-Difluoro-2-methoxybenzonitrile;874804-08-7;MFCD06409085;SCHEMBL25207032;DTXSID901296097;3,5-Difluoro-2-methoxy-benzonitrile;CL8176;AKOS005255180;PS-8722;DB-031596;CS-0313120;A21162

Chemical Property of 3,5-Difluoro-2-methoxybenzonitrile

Chemical Property:

• Vapor Pressure: 0.0172mmHg at 25°C
• Melting Point: 33-36℃
• Refractive Index: 1.485
• Boiling Point: 254.5°C at 760 mmHg
• Flash Point: 107.7°C
• PSA: 33.02000
• Density: 1.27g/cm³
• LogP: 1.84508
• Storage Temp.: 2-8°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 169.03392011
• Heavy Atom Count: 12
• Complexity: 201

Purity/Quality:

97% ^*data from raw suppliers

3,5-Difluoro-2-methoxybenzonitrile ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1F)F)C#N