2-(Difluoromethoxy)phenyl isocyanate

Base Information

• Chemical Name: 2-(Difluoromethoxy)phenyl isocyanate
• CAS No.: 186589-03-7
• Molecular Formula: C₈H₅F₂NO₂
• Molecular Weight: 185.13
• Hs Code.: 2929109000
• European Community (EC) Number: 623-673-8
• DSSTox Substance ID: DTXSID20369868
• Mol file: 186589-03-7.mol

Synonyms:2-(Difluoromethoxy)phenyl isocyanate;186589-03-7;1-(difluoromethoxy)-2-isocyanatobenzene;2-(Difluoromethoxy)phenylisocyanate;Benzene, 1-(difluoromethoxy)-2-isocyanato-;SCHEMBL628189;DTXSID20369868;AKOS000179410;2-(Difluoromethoxy)phenyl isocyanate, 98%;EN300-270979;A813061;J-011984

Chemical Property of 2-(Difluoromethoxy)phenyl isocyanate

Chemical Property:

• Vapor Pressure: 0.123mmHg at 25°C
• Refractive Index: n20/D 1.492(lit.)
• Boiling Point: 203 °C(lit.)
• Flash Point: 199 °F
• PSA: 38.66000
• Density: 1.317 g/mL at 25 °C(lit.)
• LogP: 2.25530
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 185.02883473
• Heavy Atom Count: 13
• Complexity: 204

Purity/Quality:

98%Min ^*data from raw suppliers

2-(DIFLUOROMETHOXY)PHENYL ISOCYANATE 95.00% ^*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

Total 1 MSDS from other Authors

Useful:

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