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Structure

4-Bromo-2,6-difluorobenzoic acid

CAS
183065-68-1
Catalog Number
ACM183065681
Category
Bromine Series
Molecular Weight
237
Molecular Formula
C7H3BrF2O2

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Specification

IUPAC Name
4-bromo-2,6-difluorobenzoic acid
Canonical SMILES
C1=C(C=C(C(=C1F)C(=O)O)F)Br
InChI
InChI=1S/C7H3BrF2O2/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2H,(H,11,12)
InChI Key
IRHPJGPQWZEZRX-UHFFFAOYSA-N
Boiling Point
271.7±40.0 °C
Melting Point
201-203 °C
Density
1.872±0.06 g/ml
Hazard Statements
H302 + H312 + H332-H315-H319-H335
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of 4-Bromo-2,6-difluorobenzoic acid?

The molecular formula of 4-Bromo-2,6-difluorobenzoic acid is C7H3BrF2O2.

What is the molecular weight of 4-Bromo-2,6-difluorobenzoic acid?

The molecular weight of 4-Bromo-2,6-difluorobenzoic acid is 237.00 g/mol.

What is the IUPAC name of 4-Bromo-2,6-difluorobenzoic acid?

The IUPAC name of 4-Bromo-2,6-difluorobenzoic acid is 4-bromo-2,6-difluorobenzoic acid.

What is the InChI of 4-Bromo-2,6-difluorobenzoic acid?

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

What is the InChIKey of 4-Bromo-2,6-difluorobenzoic acid?

The InChIKey of 4-Bromo-2,6-difluorobenzoic acid is IRHPJGPQWZEZRX-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Bromo-2,6-difluorobenzoic acid?

The canonical SMILES of 4-Bromo-2,6-difluorobenzoic acid is C1=C(C=C(C(=C1F)C(=O)O)F)Br.

What is the CAS number of 4-Bromo-2,6-difluorobenzoic acid?

The CAS number of 4-Bromo-2,6-difluorobenzoic acid is 183065-68-1.

What is the European Community (EC) number of 4-Bromo-2,6-difluorobenzoic acid?

The European Community (EC) number of 4-Bromo-2,6-difluorobenzoic acid is 457-940-3.

What is the DSSTox Substance ID of 4-Bromo-2,6-difluorobenzoic acid?

The DSSTox Substance ID of 4-Bromo-2,6-difluorobenzoic acid is DTXSID80378350.

Is 4-Bromo-2,6-difluorobenzoic acid a canonicalized compound in PubChem?

Yes, 4-Bromo-2,6-difluorobenzoic acid is a canonicalized compound in PubChem.

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