3-Hydroxy-4-methoxybenzonitrile

Basic Information

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CAS Number

52805-46-6

Molecular Formula

C8H7NO2

Molecular Weight

149.15 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Melting Point

133-135°C

Boiling Point

300.8°C at 760 mmHg

Flash Point

135.7℃

SMILES

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COC1=C(C=C(C=C1)C#N)O

InChI

InChI=1S/C8H7NO2/c1-11-8-3-2-6(5-9)4-7(8)10/h2-4,10H,1H3

InChIKey

ASQHIJLQYYFUDN-UHFFFAOYSA-N

LogP

1.27248

Complexity

172

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

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Synonyms & References

English

3-Hydroxy-4-methoxybenzolcarbonitrile
MB02393
BCP26348
AM20050110
A7711
MFCD02258854
Benzonitrile, 3-hydroxy-4-Methoxy-;Gefitinib Impurity
AS-15904
AKOS005256178
XLH7N8BQ9B
FT-0602138
3-hydroxy-4-methoxy benzonitrile
BENZONITRILE, 3-HYDROXY-4-METHOXY-
DTXSID00406725
p-Cyanguajacol
AC-5294
3-hydroxy-4-methoxybenzonitrile
EN300-794502
2-methoxy-5-cyanophenol
SY005357
52805-46-6
SCHEMBL388024
CS-W002933
5-CYANO-2-METHOXYPHENOL
3-Hydroxy-4-methoxybenzonitrile
3-HYDROXY-4-METHOXYBENZONITRILE (ISOVANILLONITRILE)
3-Hydroxy-4-methoxybenzonitril
3-Hydroxy-4-methoxy-benzoesaeure-nitril
5-Cyano-2-methoxyphenol
Benzonitrile,3-hydroxy-4-Methoxy
isovanillincarbonitrile

MDL Number

MFCD02258854

Customs Code

2926909090

FAQ

What regulatory guidelines apply to 3-Hydroxy-4-methoxybenzonitrile (CAS: 52805-46-6)?

3-Hydroxy-4-methoxybenzonitrile (CAS: 52805-46-6) is subject to regulatory guidelines such as the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the European Union, and FDA/EPA requirements for chemical safety and environmental protection. Compliance with these guidelines is essential for manufacturers, importers, and users of the compound.

Are there alternatives to 3-Hydroxy-4-methoxybenzonitrile (CAS: 52805-46-6) in synthesis?

There are alternative reagents and compounds that can be used as substitutes in the synthesis of 3-Hydroxy-4-methoxybenzonitrile. Some common alternatives include 4-methoxybenzonitrile and hydroxylated derivatives of benzonitrile. These alternatives can offer similar functional groups but with different reactivity profiles, making them suitable for various synthetic strategies.

What is the market or research trend for 3-Hydroxy-4-methoxybenzonitrile (CAS: 52805-46-6)?

The market for 3-Hydroxy-4-methoxybenzonitrile (CAS: 52805-46-6) is influenced by its use in pharmaceuticals, agrochemicals, and dyes. Recent research trends focus on its potential applications in medicinal chemistry and as a precursor in organic synthesis. Demand is expected to grow due to its unique chemical properties and its role in developing new compounds.

How should waste containing 3-Hydroxy-4-methoxybenzonitrile (CAS: 52805-46-6) be handled?

Waste containing 3-Hydroxy-4-methoxybenzonitrile (CAS: 52805-46-6) should be collected and disposed of according to environmental regulations. Incineration or professional waste disposal services are recommended to ensure safe disposal. Proper handling includes minimizing environmental exposure, using appropriate protective equipment, and following local and national environmental protection guidelines to prevent contamination.