4-Bromo-2-fluoro-3-methoxybenzoic acid

Basic Information

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CAS Number

194804-92-7

Molecular Formula

C8H6BrFO3

Molecular Weight

249.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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COC1=C(C=CC(=C1F)C(=O)O)Br

InChI

InChI=1S/C8H6BrFO3/c1-13-7-5(9)3-2-4(6(7)10)8(11)12/h2-3H,1H3,(H,11,12)

InChIKey

FJOKKTOXWITJGO-UHFFFAOYSA-N

LogP

2.2949999999999995

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

200

Safety Information

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Sensitiveness

Light Sensitive/Air Sensitive

Synonyms & References

English

SCHEMBL592060
4-BROMO-2-FLUORO-3-METHOXY-BENZOIC ACID
FT-0651051
FJOKKTOXWITJGO-UHFFFAOYSA-N
SB34828
A4281
4-bromo-2-fluoro-3-methoxy-benzoic acid, AldrichCPR
SY004590
Benzoic acid, 4-bromo-2-fluoro-3-methoxy-
CS-0150533
AMY21487
AKOS015909496
BB 0260770
DTXSID00582871
BS-31954
4-Bromo-2-fluoro-3-methoxybenzoic acid
AB1248
MFCD06656802
194804-92-7
4-bromo-2-fluoro-3-methoxy-benzoic acid
Benzoic acid,4-bromo-2-fluoro-3-methoxy-
PC2960
RW3692

MDL Number

MFCD06656802

Customs Code

2918990090

FAQ

What regulatory guidelines apply to 4-Bromo-2-fluoro-3-methoxybenzoic acid (CAS: 194804-92-7)?

4-Bromo-2-fluoro-3-methoxybenzoic acid (CAS: 194804-92-7) falls under GHS classification as a hazardous chemical. It is subject to REACH regulations in the European Union, requiring manufacturers and importers to register the substance and provide safety data sheets. In the USA, the FDA and EPA have specific requirements for handling and reporting of this compound, including environmental discharge and waste management.

Are there alternatives to 4-Bromo-2-fluoro-3-methoxybenzoic acid in synthesis?

For synthesis, alternatives to 4-Bromo-2-fluoro-3-methoxybenzoic acid (CAS: 194804-92-7) include other brominated and fluorinated benzoic acids, such as 2-bromo-3-methoxybenzoic acid or 3-bromo-2-fluoro-4-methoxybenzoic acid. These compounds can serve as effective substitutes depending on the specific reaction conditions and desired product.

What is the market or research trend for 4-Bromo-2-fluoro-3-methoxybenzoic acid (CAS: 194804-92-7)?

The market for 4-Bromo-2-fluoro-3-methoxybenzoic acid (CAS: 194804-92-7) is driven by its use in pharmaceutical and fine chemical research. Recent trends show growing interest in its application as an intermediate for drug synthesis, particularly in antiviral and anticancer drug development. Research is also focusing on its potential in materials science and environmental sensing.

How should waste containing 4-Bromo-2-fluoro-3-methoxybenzoic acid (CAS: 194804-92-7) be handled?

Waste containing 4-Bromo-2-fluoro-3-methoxybenzoic acid (CAS: 194804-92-7) should be collected in appropriate containers and treated as hazardous waste. It is advisable to incinerate the waste under controlled conditions or use professional waste disposal services that adhere to environmental protection regulations. Proper labeling and documentation of waste disposal are essential to comply with regulatory requirements.