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Structure

5-Bromo-2-fluorobenzoic acid

CAS
146328-85-0
Catalog Number
ACM146328850
Category
Bromine Series
Molecular Weight
219.01
Molecular Formula
C7H4BrFO2

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Specification

Synonyms
Benzoic acid, 5-broMo-2-fluoro-
IUPAC Name
5-bromo-2-fluorobenzoic acid
Canonical SMILES
C1=CC(=C(C=C1Br)C(=O)O)F
InChI
InChI=1S/C7H4BrFO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H,10,11)
InChI Key
PEXAZYDITWXYNJ-UHFFFAOYSA-N
Boiling Point
296.5±25.0 ºC
Melting Point
141-145 ºC (lit.)
Density
1.789±0.06 g/ml
Hazard Statements
H302-H315-H319-H335
RIDADR
UN 2811 6.1 / PGIII
Symbol
GHS07
What is the molecular formula of 5-Bromo-2-fluorobenzoic acid?

The molecular formula of 5-Bromo-2-fluorobenzoic acid is C7H4BrFO2.

When was 5-Bromo-2-fluorobenzoic acid first created?

5-Bromo-2-fluorobenzoic acid was first created on July 19, 2005.

How is the IUPAC Name of 5-Bromo-2-fluorobenzoic acid computed?

The IUPAC Name of 5-Bromo-2-fluorobenzoic acid is computed by Lexichem TK 2.7.0.

What is the Canonical SMILES of 5-Bromo-2-fluorobenzoic acid?

The Canonical SMILES of 5-Bromo-2-fluorobenzoic acid is C1=CC(=C(C=C1Br)C(=O)O)F.

What is the CAS number of 5-Bromo-2-fluorobenzoic acid?

The CAS number of 5-Bromo-2-fluorobenzoic acid is 146328-85-0.

What is the molecular weight of 5-Bromo-2-fluorobenzoic acid?

The molecular weight of 5-Bromo-2-fluorobenzoic acid is 219.01 g/mol.

How many hydrogen bond acceptors does 5-Bromo-2-fluorobenzoic acid have?

5-Bromo-2-fluorobenzoic acid has 3 hydrogen bond acceptors.

What is the topological polar surface area of 5-Bromo-2-fluorobenzoic acid?

The topological polar surface area of 5-Bromo-2-fluorobenzoic acid is 37.3Ų.

Is 5-Bromo-2-fluorobenzoic acid a covalently-bonded unit?

Yes, 5-Bromo-2-fluorobenzoic acid is a covalently-bonded unit.

How many rotatable bonds does 5-Bromo-2-fluorobenzoic acid have?

5-Bromo-2-fluorobenzoic acid has 1 rotatable bond.

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