2-Fluoro-4-iodophenyl isocyanate

Base Information

• Chemical Name: 2-Fluoro-4-iodophenyl isocyanate
• CAS No.: 139072-17-6
• Molecular Formula: C7H3FINO
• Molecular Weight: 263.01
• Hs Code.: 2929109000
• European Community (EC) Number: 623-263-9
• DSSTox Substance ID: DTXSID40404886
• Mol file: 139072-17-6.mol

Synonyms:2-Fluoro-4-iodophenyl isocyanate;139072-17-6;2-fluoro-4-iodo-1-isocyanatobenzene;2-FLUORO-4-IODOPHENYL ISOCYANATE 95;4-Iodo-2-fluorophenyl isocyanate;SCHEMBL624867;DTXSID40404886;VBRWSMMFMURCHF-UHFFFAOYSA-N;2-Fluoro-4-iodophenyl isocyanate, 95%;J-007218

Chemical Property of 2-Fluoro-4-iodophenyl isocyanate

Chemical Property:

• Vapor Pressure: 0.0209mmHg at 25°C
• Refractive Index: n20/D 1.6150(lit.)
• Boiling Point: 206-207 °C(lit.)
• Flash Point: >230 °F
• PSA: 29.43000
• Density: 1.949 g/mL at 25 °C(lit.)
• LogP: 2.39760
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 262.92434
• Heavy Atom Count: 11
• Complexity: 181

Purity/Quality:

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

2-Fluoro-4-iodophenyl isocyanate 95% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1I)F)N=C=O