2-Chloro-4-fluorobenzoic acid

• Catalog Number: ACM2252519
• Product Name: 2-Chloro-4-fluorobenzoic acid
• CAS: 2252-51-9
• Category: Aryl Fluorinated Building Blocks
• Synonyms: Benzoic acid, 2-chloro-4-fluoro-
• IUPAC Name: 2-chloro-4-fluorobenzoic acid
• Molecular Weight: 174.56
• Molecular Formula: C7H4ClFO2
• Canonical SMILES: C1=CC(=C(C=C1F)Cl)C(=O)O
• InChI: InChI=1S/C7H4ClFO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,(H,10,11)
• InChI Key: GRPWQLDSGNZEQE-UHFFFAOYSA-N
• Boiling Point: 271.9±20.0 ºC
• Melting Point: 181-183 ºC (lit.)
• Density: 1.402 g/ml
• Hazard Statements: H302
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 2-Chloro-4-fluorobenzoic acid?

The molecular formula of 2-Chloro-4-fluorobenzoic acid is C7H4ClFO2.

What is the molecular weight of 2-Chloro-4-fluorobenzoic acid?

The molecular weight of 2-Chloro-4-fluorobenzoic acid is 174.55 g/mol.

What is the IUPAC name of 2-Chloro-4-fluorobenzoic acid?

The IUPAC name of 2-Chloro-4-fluorobenzoic acid is 2-chloro-4-fluorobenzoic acid.

What is the InChI of 2-Chloro-4-fluorobenzoic acid?

The InChI of 2-Chloro-4-fluorobenzoic acid is InChI=1S/C7H4ClFO2/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3H,(H,10,11).

What is the InChIKey of 2-Chloro-4-fluorobenzoic acid?

The InChIKey of 2-Chloro-4-fluorobenzoic acid is GRPWQLDSGNZEQE-UHFFFAOYSA-N.

What is the CAS number of 2-Chloro-4-fluorobenzoic acid?

The CAS number of 2-Chloro-4-fluorobenzoic acid is 2252-51-9.

What is the European Community number of 2-Chloro-4-fluorobenzoic acid?

The European Community number of 2-Chloro-4-fluorobenzoic acid is 218-845-0.

What is the DSSTox Substance ID of 2-Chloro-4-fluorobenzoic acid?

The DSSTox Substance ID of 2-Chloro-4-fluorobenzoic acid is DTXSID90177038.

What is the XLogP3 value of 2-Chloro-4-fluorobenzoic acid?

The XLogP3 value of 2-Chloro-4-fluorobenzoic acid is 2.3.

Is 2-Chloro-4-fluorobenzoic acid a canonicalized compound?

Yes, 2-Chloro-4-fluorobenzoic acid is a canonicalized compound.