472190

2-Fluoro-5-(trifluoromethyl)phenyl isocyanate

97%

• Linear Formula: FC₆H₃(CF₃)NCO
• CAS Number: 69922-27-6
• Molecular Weight: 205.11
• MDL number: MFCD00673069
• UNSPSC Code: 12352100
• PubChem Substance ID: 24870787
• NACRES: NA.22

Properties

• assay: 97%
• refractive index: n20/D 1.455 (lit.)
• bp: 53 °C/2.5 mmHg (lit.)
• density: 1.418 g/mL at 25 °C (lit.)
• functional group: fluoro; isocyanate
• SMILES string: Fc1ccc(cc1N=C=O)C(F)(F)F
• InChI: 1S/C8H3F4NO/c9-6-2-1-5(8(10,11)12)3-7(6)13-4-14/h1-3H
• InChI key: NAIKHCBDZGSGHH-UHFFFAOYSA-N

Description

General description

2-Fluoro-5-(trifluoromethyl)phenyl isocyanate is a fluorinated building block.

Application

Useful pharmaceutical building block for the preparation of ureas from amines.

Safety Information

• pictograms: GHS08,GHS07
• signalword: Danger
• hcodes: H302 + H312 + H332,H315,H317,H319,H334,H335
• pcodes: P261 - P264 - P280 - P301 + P312 - P302 + P352 + P312 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 3
• flash_point_f: 159.8 °F - closed cup
• flash_point_c: 71 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter