3,5-Bis(trifluoromethyl)phenyl isocyanate, 98%, Thermo Scientific Chemicals

Description

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Specifications

Chemical Identifiers

• CAS: 16588-74-2
• Molecular Formula: C₉H₃F₆NO
• Molecular Weight (g/mol): 255.12
• MDL Number: MFCD00013559
• InChI Key: NRSSOFNMWSJECS-UHFFFAOYSA-N
• Synonym: 3,5-bis trifluoromethyl phenylisocyanate, 3,5-bis trifluoromethyl phenyl isocyanate, 1-isocyanato-3,5-bis trifluoromethyl benzene, 3,5-bis trifluoromethyl isocyanate, 3,5-di trifluoromethyl phenyl isocyanate, 3,5-di trifluoromethyl phenylisocyanate, 3,5-bis trifluoromethyl benzenisocyanate, pubchem2735, acmc-209dtj, 3,5-bistrifluorometylphenylisocyanate
• PubChem CID: 2733314
• IUPAC Name: 1-isocyanato-3,5-bis(trifluoromethyl)benzene
• SMILES: C1=C(C=C(C=C1C(F)(F)F)N=C=O)C(F)(F)F

• CAS Min %: 97.5
• CAS Max %: 100.0
• Color: Colorless
• Density: 1.4700g/mL
• Boiling Point: 62.0°C (2.0 mmHg)
• Flash Point: 67°C
• Infrared Spectrum: Authentic
• Assay Percent Range: 97.5% min. (GC)
• Packaging: Glass bottle
• Refractive Index: 1.4295 to 1.4315
• Linear Formula: (CF₃)₂C₆H₃NCO
• Quantity: 5 g
• Specific Gravity: 1.47
• Formula Weight: 255.12
• Percent Purity: 98%
• Physical Form: Liquid
• Chemical Name or Material: 3, 5-Bis(trifluoromethyl)phenyl isocyanate, 98%

Safety and Handling

Hazard Category	GHS Signal Word: Warning
Hazard Statement	GHS H Statement Causes serious eye irritation. May cause respiratory irritation. Harmful if swallowed. Harmful if inhaled. Harmful in contact with skin. Causes skin irritation.
Precautionary Statement	GHS P Statement Wear protective gloves/protective clothing/eye protection/face protection. IF ON SKIN: Wash with plenty of soap and water. Avoid breathing dust/fume/gas/mist/vapors/spray. IF SWALLOWED: Call a POISON CENTER or doctor
TSCA	TSCA

SDS

RUO – Research Use Only