2-(Trifluoromethoxy)benzoic acid

• CAS: 1979-29-9
• Catalog Number: ACM1979299
• Category: Ethers
• Molecular Weight: 206.12
• Molecular Formula: C8H5F3O3
• Synonyms: Benzoic acid, 2-(trifluoromethoxy)-
• IUPAC Name: 2-(trifluoromethoxy)benzoic acid
• Canonical SMILES: C1=CC=C(C(=C1)C(=O)O)OC(F)(F)F
• InChI: InChI=1S/C8H5F3O3/c9-8(10,11)14-6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13)
• InChI Key: JMYSPFGUBNENSE-UHFFFAOYSA-N
• Boiling Point: 231.6±35.0 ºC
• Melting Point: 78 ºC
• Density: 1.447±0.06 g/ml
• Hazard Statements: H317
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 2-(Trifluoromethoxy)benzoic acid?

The molecular formula of 2-(Trifluoromethoxy)benzoic acid is C8H5F3O3.

What is the molecular weight of 2-(Trifluoromethoxy)benzoic acid?

The molecular weight of 2-(Trifluoromethoxy)benzoic acid is 206.12 g/mol.

What is the IUPAC name of 2-(Trifluoromethoxy)benzoic acid?

The IUPAC name of 2-(Trifluoromethoxy)benzoic acid is 2-(trifluoromethoxy)benzoic acid.

What is the InChI of 2-(Trifluoromethoxy)benzoic acid?

The InChI of 2-(Trifluoromethoxy)benzoic acid is InChI=1S/C8H5F3O3/c9-8(10,11)14-6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13).

What is the InChIKey of 2-(Trifluoromethoxy)benzoic acid?

The InChIKey of 2-(Trifluoromethoxy)benzoic acid is JMYSPFGUBNENSE-UHFFFAOYSA-N.

What is the canonical SMILES of 2-(Trifluoromethoxy)benzoic acid?

The canonical SMILES of 2-(Trifluoromethoxy)benzoic acid is C1=CC=C(C(=C1)C(=O)O)OC(F)(F)F.

What is the CAS number of 2-(Trifluoromethoxy)benzoic acid?

The CAS number of 2-(Trifluoromethoxy)benzoic acid is 1979-29-9.

What is the European Community (EC) number of 2-(Trifluoromethoxy)benzoic acid?

The European Community (EC) number of 2-(Trifluoromethoxy)benzoic acid is 670-401-9.

What is the XLogP3 value of 2-(Trifluoromethoxy)benzoic acid?

The XLogP3 value of 2-(Trifluoromethoxy)benzoic acid is 2.8.

Is 2-(Trifluoromethoxy)benzoic acid a covalently-bonded unit?

Yes, 2-(Trifluoromethoxy)benzoic acid is a covalently-bonded unit.