[4-(Ethoxycarbonyl)-3-fluorophenyl]boronic acid

Basic Information

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CAS Number

874288-38-7

Molecular Formula

C9H10BFO4

Molecular Weight

211.99 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

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

Melting Point

158-161°C

Boiling Point

370.5°C at 760 mmHg

SMILES

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CCOC(=O)C1=C(F)C=C(C=C1)B(O)O

InChI

InChI=1S/C9H10BFO4/c1-2-15-9(12)7-4-3-6(10(13)14)5-8(7)11/h3-5,13-14H,2H2,1H3

InChIKey

CXSPPZZTTSHTMP-UHFFFAOYSA-N

LogP

-0.31779999999999997

Topological Polar Surface Area

66.76 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

224

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

4-Ethoxycarbonyl-3-fluorophenylboronic acid
4-Ethoxycarbonyl-3-fluorobenzeneboronic acid
4-(Ethoxycarbonyl)-3-fluorophenylboronic Acid (contains varying amounts of Anhydride)
[4-(ethoxycarbonyl)-3-fluorophenyl]boronic acid
(4-ethoxycarbonyl-3-fluorophenyl)boronic acid
4-(Ethoxycarbonyl)-3-fluorophenylboronic acid
4-(Ethoxycarbonyl)-3-fluorobenzeneboronic Acid (contains varying amounts of Anhydride)
Ethyl 4-borono-2-fluorobenzoate
4-(Ethoxycarbonyl)-3-fluorobenzeneboronic acid
(4-ethoxycarbonyl-3-fluoro-phenyl)boronic Acid
CXSPPZZTTSHTMP-UHFFFAOYSA-N
SBB094567
PC2999
4-ethoxycarbonyl-3-fluorophenylboronic acid
1-Ethyl 4-borono-2-fluorobenzoate (ACI)

MDL Number

MFCD06656274

Customs Code

2931900090

FAQ

What regulatory guidelines apply to [4-(Ethoxycarbonyl)-3-fluorophenyl]boronic acid (CAS: 874288-38-7)?

The [4-(Ethoxycarbonyl)-3-fluorophenyl]boronic acid (CAS: 874288-38-7) must comply with the Globally Harmonized System (GHS) of Classification and Labeling of Chemicals, REACH regulations in the EU, and FDA/EPA guidelines for chemical substances. Specific requirements include hazard communication, product classification, and environmental protection measures.

Are there alternatives to [4-(Ethoxycarbonyl)-3-fluorophenyl]boronic acid (CAS: 874288-38-7) in synthesis?

Synthetic alternatives to [4-(Ethoxycarbonyl)-3-fluorophenyl]boronic acid include other boronic acids and acid derivatives. Common substitutes include 4-(trifluoromethyl)phenylboronic acid and 2-fluorophenylboronic acid, which offer similar reactivity and functionality in various organic synthesis processes.

What is the market or research trend for [4-(Ethoxycarbonyl)-3-fluorophenyl]boronic acid (CAS: 874288-38-7)?

The market for [4-(Ethoxycarbonyl)-3-fluorophenyl]boronic acid (CAS: 874288-38-7) is growing due to its application in pharmaceutical and academic research. Recent trends include increased usage in medicinal chemistry and bioconjugation studies, as well as growing interest in its use as a key intermediate in the synthesis of complex molecules.

How should waste containing [4-(Ethoxycarbonyl)-3-fluorophenyl]boronic acid (CAS: 874288-38-7) be handled?

Waste containing [4-(Ethoxycarbonyl)-3-fluorophenyl]boronic acid (CAS: 874288-38-7) should be collected in a sealed container and disposed of through a professional hazardous waste disposal service. Incineration is a common method, but ensure compliance with local environmental regulations. Always adhere to safety precautions and follow disposal guidelines to prevent environmental contamination.