2-bromo-4,5-difluorobenzoic acid

• CAS: 64695-84-7
• Catalog Number: ACM64695847
• Category: Bromine Series
• Molecular Weight: 237
• Molecular Formula: C7H3BrF2O2
• Synonyms: Benzoic acid,2-broMo-4,5-difluoro-
• IUPAC Name: 2-bromo-4,5-difluorobenzoic acid
• Canonical SMILES: C1=C(C(=CC(=C1F)F)Br)C(=O)O
• InChI: InChI=1S/C7H3BrF2O2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H,(H,11,12)
• InChI Key: DGCBGBZYTNTZJH-UHFFFAOYSA-N
• Boiling Point: 291.3±40.0 ºC
• Melting Point: 118-122 ºC (lit.)
• Density: 1.872±0.06 g/ml
• Hazard Statements: H315-H319-H335
• RIDADR: UN 3439 6.1 / PGIII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 2-Bromo-4,5-difluorobenzoic acid?

The molecular formula is C7H3BrF2O2.

What is the molecular weight of 2-Bromo-4,5-difluorobenzoic acid?

The molecular weight is 237.00 g/mol.

What is the IUPAC Name of 2-Bromo-4,5-difluorobenzoic acid?

The IUPAC Name is 2-bromo-4,5-difluorobenzoic acid.

What is the InChI of 2-Bromo-4,5-difluorobenzoic acid?

The InChI is InChI=1S/C7H3BrF2O2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H,(H,11,12).

What is the InChIKey of 2-Bromo-4,5-difluorobenzoic acid?

The InChIKey is DGCBGBZYTNTZJH-UHFFFAOYSA-N.

What is the Canonical SMILES of 2-Bromo-4,5-difluorobenzoic acid?

The Canonical SMILES is C1=C(C(=CC(=C1F)F)Br)C(=O)O.

What is the CAS number of 2-Bromo-4,5-difluorobenzoic acid?

The CAS number is 64695-84-7.

What is the European Community (EC) Number of 2-Bromo-4,5-difluorobenzoic acid?

The European Community (EC) Number is 629-562-0.

What is the Heavy Atom Count of 2-Bromo-4,5-difluorobenzoic acid?

The Heavy Atom Count is 12.

Is 2-Bromo-4,5-difluorobenzoic acid a canonicalized compound?

Yes, it is a canonicalized compound.