2,4,6-Trimethoxybenzaldehyde

Basic Information

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CAS Number

830-79-5

Molecular Formula

C10H12O4

Molecular Weight

196.2 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

115-120 °C

Boiling Point

339.1°C at 760 mmHg

Density

1.2166 (rough estimate)

Water Solubility

Insoluble in water.

Flash Point

151.3℃

Refractive Index

1.5550 (estimate)

SMILES

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COC1=CC(=C(C(=C1)OC)C=O)OC

InChI

InChI=1S/C10H12O4/c1-12-7-4-9(13-2)8(6-11)10(5-7)14-3/h4-6H,1-3H3

InChIKey

CRBZVDLXAIFERF-UHFFFAOYSA-N

LogP

1.5249

Topological Polar Surface Area

44.760000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

169

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

Sensitiveness

Air Sensitive

Synonyms & References

English

AKOS000120758
CS-W009225
SY015346
A842494
UNII-JD365X6J84
AC-12837
NS00038236
AI3-36672
2,4,6-Trimethoxybenzaldehyde
MFCD00003313
CK2089
830-79-5
AM20050246
T2651
CRBZVDLXAIFERF-UHFFFAOYSA-
AS-14420
SCHEMBL34873
InChI=1/C10H12O4/c1-12-7-4-9(13-2)8(6-11)10(5-7)14-3/h4-6H,1-3H3
ZB1376
JD365X6J84
F0001-2130
DTXSID70232119
EINECS 212-598-2
EN300-17219
Z56899127
2,4,6-Trimethoxybenzaldehyde, 98%
A840488
AB-131/40897219
BCP33590
2,4,6-Trimethoxy-benzaldehyde
BRN 1956051

MDL Number

MFCD00003313

Customs Code

2912499000

FAQ

What is 2,4,6-Trimethoxybenzaldehyde (CAS: 830-79-5)?

2,4,6-Trimethoxybenzaldehyde is an aromatic aldehyde with three methoxy groups attached to the benzene ring. Its chemical formula is C10H12O3, and it is a white crystalline solid with a faint aromatic odor. It is known for its moderate solubility in organic solvents and is commonly used in chemical research and synthesis due to its versatile functional groups.

What are the main uses of 2,4,6-Trimethoxybenzaldehyde (CAS: 830-79-5)?

2,4,6-Trimethoxybenzaldehyde is primarily used in the pharmaceutical industry as an intermediate in the synthesis of drugs and agrochemicals. It also finds applications in organic synthesis, fragrance development, and as a reagent in chemical research. Its unique structure makes it valuable for creating derivatives with varied biological and chemical properties.

Is 2,4,6-Trimethoxybenzaldehyde (CAS: 830-79-5) safe?

2,4,6-Trimethoxybenzaldehyde is generally considered safe in controlled conditions, but it requires proper handling to avoid exposure. It may cause irritation to the eyes, skin, and respiratory system. Safety standards recommend using personal protective equipment (PPE) such as gloves, goggles, and a lab coat when working with this compound. Always follow standard chemical safety protocols.

How should 2,4,6-Trimethoxybenzaldehyde (CAS: 830-79-5) be stored?

2,4,6-Trimethoxybenzaldehyde should be stored in a cool, dry, and dark place, away from moisture and incompatible substances. It is best kept in a sealed container at temperatures below 25°C. Avoid exposure to air and light to maintain its stability and prevent degradation over time.