Coniferaldehyde

Basic Information

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CAS Number

458-36-6

Molecular Formula

C10H10O3

Molecular Weight

178.18 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 Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

80-82 °C

Boiling Point

175 °C/5 mmHg

Flash Point

136.8°C

Refractive Index

1.65635

SMILES

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O=C/C=C/c1ccc(c(c1)OC)O

InChI

InChI=1S/C10H10O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-7,12H,1H3/b3-2+

InChIKey

DKZBBWMURDFHNE-NSCUHMNNSA-N

LogP

1.6129

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

189

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

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

Storage Conditions

2-8℃

Synonyms & References

English

4-Hydroxy-3-methoxycinnamaldehyde
2-Propenal,3-(4-hydroxy-3-methoxyphenyl)-
(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enal
Coniferaldehyde
CONIFERALDEHYDE(P)
4-hydroxy-3-methoxy-benzaldehyde
4-hydroxy-3-methoxycinnamic aldehyde
4-hydroxy-3-methoxy-cinnamon-aldehyde
Coniferyl aldehyde
Ferulaldehyde
4-Hydroxy-3-methoxyzimtaldehyde
Ferulyl aldehyde
p-Coniferaldehyde
coniferylaldehyde
3-(4-Hydroxy-3-methoxyphenyl)acrylaldehyde
(E)-3-(4-Hydroxy-3-methoxyphenyl)acrylaldehyde
3-(4-Hydroxy-3-methoxyphenyl)prop-2-enal
3-Methoxy-4-hydroxycinnamaldehyde
(2e)-3-(4-Hydroxy-3-Methoxyphenyl)prop-2-Enal
Cinnamaldehyde, 4-hydroxy-3-methoxy-
2-Propenal, 3-(4-hydroxy-3-methoxyphenyl)-, (2E)-
06TPT01AD5
DKZBBWMURDFH
coniferyl aldehydel
p-Coniferaldehyde,Coniferyl aldehyde,Ferulaldehyde,Ferulyl aldehyde

MDL Number

MFCD00075811

Customs Code

2912499000

FAQ

What are the physical and chemical properties of Coniferaldehyde (CAS: 458-36-6)?

Coniferaldehyde (CAS: 458-36-6) is a clear, colorless to light yellow liquid with a molecular weight of approximately 148.16 g/mol. It has a high solubility in common organic solvents but is poorly soluble in water. Chemically, it is moderately reactive, especially under acidic or basic conditions. It can undergo condensation and oxidation reactions, making it useful in synthetic chemistry.

How is Coniferaldehyde (CAS: 458-36-6) typically synthesized?

Coniferaldehyde can be synthesized via the oxidation of coniferyl alcohol using peroxyacetic acid or other oxidizing agents. The process typically yields high selectivity and a good overall yield, with the reaction often taking place in an aqueous-acidic medium. This method is widely used due to its simplicity and efficiency.

What industries use Coniferaldehyde (CAS: 458-36-6)?

Coniferaldehyde (CAS: 458-36-6) is primarily used in the pharmaceutical industry for the synthesis of various compounds, including certain drug intermediates. It also finds applications in the production of polymers, where it serves as a precursor for functionalized polymers. Additionally, it has uses in the development of sensors and semiconductors due to its structural properties.

What precautions should be taken when handling Coniferaldehyde (CAS: 458-36-6)?

When handling Coniferaldehyde (CAS: 458-36-6), it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or fume hood to minimize inhalation risks. Spills should be cleaned up using appropriate absorbents and disposing of waste according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.