4-Iodo-3-(trifluoromethoxy)benzonitrile

Base Information

• Chemical Name: 4-Iodo-3-(trifluoromethoxy)benzonitrile
• CAS No.: 886762-66-9
• Molecular Formula: C8H3F3INO
• Molecular Weight: 313.02
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID10382460
• Wikidata: Q82173818
• Mol file: 886762-66-9.mol

Synonyms:4-iodo-3-(trifluoromethoxy)benzonitrile;886762-66-9;DTXSID10382460;MFCD07368784;AKOS022171831;PS-7076;CS-0322070

Chemical Property of 4-Iodo-3-(trifluoromethoxy)benzonitrile

Chemical Property:

• PSA: 33.02000
• LogP: 3.06148
• Storage Temp.: 2-8°C
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 312.92115
• Heavy Atom Count: 14
• Complexity: 247

Purity/Quality:

97% ^*data from raw suppliers

4-Iodo-3-(trifluoromethoxy)benzonitrile ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1C#N)OC(F)(F)F)I