4-Formyl-3-hydroxybenzonitrile

Basic Information

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CAS Number

84102-89-6

Molecular Formula

C8H5NO2

Molecular Weight

17.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Aldehydes

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Boiling Point

276.856°C at 760 mmHg

SMILES

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N#CC1=CC=C(C=O)C(O)=C1

InChI

InChI=1S/C8H5NO2/c9-4-6-1-2-7(5-10)8(11)3-6/h1-3,5,11H

InChIKey

DZETWSGVBUVPMH-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

4-Formyl-3-hydroxybenzonitrile
BENZONITRILE, 4-FORMYL-3-HYDROXY-
4-cyano-2-hydroxybenzaldehyde
4-formyl-3-hydroxy-Benzonitrile
5-Cyano-2-formylphenol
BEN165
Benzonitrile,4-formyl-3-hydroxy

MDL Number

MFCD08361770

Customs Code

2926909090

FAQ

What regulatory guidelines apply to 4-Formyl-3-hydroxybenzonitrile (CAS: 84102-89-6)?

4-Formyl-3-hydroxybenzonitrile (CAS: 84102-89-6) is regulated under the GHS (Globally Harmonized System of Classification and Labelling of Chemicals) for hazardous properties such as flammability and toxicity. It is also subject to the REACH regulations in the European Union for registration, evaluation, authorization, and restriction of chemicals. FDA/EPA guidelines may apply for its use in pharmaceuticals and environmental discharge, respectively.

Are there alternatives to 4-Formyl-3-hydroxybenzonitrile (CAS: 84102-89-6) in synthesis?

Alternatives to 4-Formyl-3-hydroxybenzonitrile (CAS: 84102-89-6) include its isomers and analogs such as 3-Hydroxy-4-formylbenzonitrile. Common alternative reagents in synthesis include formic acid and hydroxybenzonitrile derivatives. These alternatives can provide similar functional groups for various chemical reactions.

What is the market or research trend for 4-Formyl-3-hydroxybenzonitrile (CAS: 84102-89-6)?

The market for 4-Formyl-3-hydroxybenzonitrile (CAS: 84102-89-6) is primarily driven by its applications in pharmaceuticals and organic synthesis. Research trends focus on its use as a precursor in the development of new drugs and as a building block in organic chemistry. Recent studies are exploring its potential in biodegradable materials and as a functional material in electronics.

How should waste containing 4-Formyl-3-hydroxybenzonitrile (CAS: 84102-89-6) be handled?

Waste containing 4-Formyl-3-hydroxybenzonitrile (CAS: 84102-89-6) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method for disposal, but it requires proper containment to prevent air pollution. Environmental protection measures include minimizing water contamination and ensuring waste is not released into the environment. Compliance with local regulations is essential for safe disposal.