153079

3-Nitrobenzotrifluoride

97%

• Synonym(s): 3-Nitro-α,α,α-trifluorotoluene
• Linear Formula: O₂NC₆H₄CF₃
• CAS Number: 98-46-4
• Molecular Weight: 191.11
• EC Number: 202-670-1
• MDL number: MFCD00007260
• UNSPSC Code: 12352100
• PubChem Substance ID: 24849283
• NACRES: NA.22

Properties

• Quality Level: 100
• Assay: 97%
• form: liquid
• refractive index: n20/D 1.472 (lit.)
• bp: 200-205 °C (lit.)
• density: 1.436 g/mL at 25 °C (lit.)
• functional group: fluoro; nitro
• SMILES string: [O-][N+](=O)c1cccc(c1)C(F)(F)F
• InChI: 1S/C7H4F3NO2/c8-7(9,10)5-2-1-3-6(4-5)11(12)13/h1-4H
• InChI key: WHNAMGUAXHGCHH-UHFFFAOYSA-N

Safety Information

• Pictograms: GHS06
• Signal Word: Danger
• Hazard Statements: H302,H315,H319,H330,H335
• Precautionary Statements: P260 - P264 - P301 + P312 - P302 + P352 - P304 + P340 + P310 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class Code: 6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
• WGK: WGK 2
• Flash Point(F): 190.4 °F - closed cup
• Flash Point(C): 88 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves