4-Bromo-3,5-dimethoxybenzaldehyde

Basic Information

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CAS Number

31558-40-4

Molecular Formula

C9H9BrO3

Molecular Weight

245.07 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

Light-red to Brown Solid

Melting Point

113.0 to 117.0 deg-C

Boiling Point

336.6°C at 760 mmHg

SMILES

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COC1=CC(=CC(=C1Br)OC)C=O

InChI

InChI=1S/C9H9BrO3/c1-12-7-3-6(5-11)4-8(13-2)9(7)10/h3-5H,1-2H3

InChIKey

UGBJRYUNSXFPOX-UHFFFAOYSA-N

LogP

2.2788000000000004

Topological Polar Surface Area

35.53 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

160

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

Synonyms & References

English

UNII-295D5VM0AP
4-Bromo-3,5-dimethoxy benzaldehyde
AKOS005256467
Z1269194191
4-Bromo-3,5-dimethoxybenzaldehyde, AldrichCPR
4-Bromo-3,5-dimethoxybenzaldehyde
W-106890
FT-0602379
BCP24276
295D5VM0AP
3,5-Dimethoxy-4-bromobenzaldehyde
NS00029130
3,5-Dimethoxy-4-bromobenzaldehyde;4-Bromo-3,5-dimethoxybenzaldehyde
DTXSID50185457
AC-1489
Benzaldehyde, 4-bromo-3,5-dimethoxy-
31558-40-4
AMY15225
4-bromo-3,5-dimethoxy-benzaldehyde
EN300-1707448
EINECS 250-698-8
SCHEMBL918118
UGBJRYUNSXFPOX-UHFFFAOYSA-N
GS-3336
CS-W014129
B2952
MFCD00040799
3,5-Dimethoxy-4-bromo-benzaldehyde
4-Brom-3,5-dimethoxy-benzaldehyd

MDL Number

MFCD00040799

Customs Code

2913000090

FAQ

What regulatory guidelines apply to 4-Bromo-3,5-dimethoxybenzaldehyde (CAS: 31558-40-4)?

4-Bromo-3,5-dimethoxybenzaldehyde (CAS: 31558-40-4) is subject to the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), REACH regulations in the EU, and FDA and EPA requirements in the USA. It is classified as a hazardous substance due to its potential for skin and eye irritation and carcinogenicity. Proper handling, storage, and labeling are required, and users must comply with local and international regulations to ensure safety and environmental protection.

Are there alternatives to 4-Bromo-3,5-dimethoxybenzaldehyde (CAS: 31558-40-4) in synthesis?

There are several alternatives to 4-Bromo-3,5-dimethoxybenzaldehyde (CAS: 31558-40-4) in synthesis, including 4-chloro-3,5-dimethoxybenzaldehyde, 4-fluoro-3,5-dimethoxybenzaldehyde, and 3,5-dimethoxybenzaldehyde. These compounds can serve as viable substitutes depending on the specific reaction conditions and desired properties. Synthesizing with these alternatives can reduce the need for bromine, a potentially hazardous reagent.

What is the market or research trend for 4-Bromo-3,5-dimethoxybenzaldehyde (CAS: 31558-40-4)?

The market for 4-Bromo-3,5-dimethoxybenzaldehyde (CAS: 31558-40-4) is primarily driven by its use in pharmaceuticals, dyes, and organic synthesis. Research trends indicate a growing interest in developing safer and more sustainable alternatives due to its classification as a hazardous substance. The trend also includes exploring its applications in more environmentally friendly chemical processes and formulations.

How should waste containing 4-Bromo-3,5-dimethoxybenzaldehyde (CAS: 31558-40-4) be handled?

Waste containing 4-Bromo-3,5-dimethoxybenzaldehyde (CAS: 31558-40-4) should be collected in a suitable container with appropriate labeling. The waste should be neutralized if necessary and then disposed of through a professional hazardous waste disposal service. Incineration is another viable method, but it must be conducted under controlled conditions to ensure safety and minimize environmental impact. Proper waste management and disposal are crucial to comply with environmental regulations and ensure public health protection.