3,5-Dimethoxy-4-hydroxycinnamic acid, 98%, predominantly trans isomer, Thermo Scientific Chemicals

Product Code	Brand	Quantity	Packaging
10428450	Thermo Scientific Acros 115550010	1 g	Glass bottle
10356130	Thermo Scientific 115550050	5 g	Glass bottle
11915121	Thermo Scientific Acros 115550250	25 g	Glass bottle

Description

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Chemical Identifiers

• CAS: 530-59-6
• Molecular Weight (g/mol): 224.21
• Synonym: sinapic acid, sinapinic acid, 3,5-dimethoxy-4-hydroxycinnamic acid, sinapinate, sinapate, trans-sinapic acid, 4-hydroxy-3,5-dimethoxycinnamic acid, synapoic acid, 2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid, unii-p0i60993ec
• ChEBI: CHEBI:15714
• SMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)O

• Molecular Formula: C₁₁H₁₂O₅
• InChI Key: PCMORTLOPMLEFB-ONEGZZNKSA-N
• PubChem CID: 637775
• IUPAC Name: (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid

Specifications

• CAS: 530-59-6
• CAS Max %: 100.0
• Color: Beige-Yellow to Yellow
• Assay Percent Range: 98%
• Linear Formula: HOC₆H₂(OCH₃)₂CH=CHCO₂H
• Synonym: sinapic acid, sinapinic acid, 3,5-dimethoxy-4-hydroxycinnamic acid, sinapinate, sinapate, trans-sinapic acid, 4-hydroxy-3,5-dimethoxycinnamic acid, synapoic acid, 2e-3-4-hydroxy-3,5-dimethoxyphenyl prop-2-enoic acid, unii-p0i60993ec
• InChI Key: PCMORTLOPMLEFB-ONEGZZNKSA-N
• IUPAC Name: (E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoic acid
• PubChem CID: 637775
• Formula Weight: 224.21
• Physical Form: Crystalline Powder

• CAS Min %: 97.5
• Melting Point: 203.0°C to 205.0°C
• Infrared Spectrum: Authentic
• Molecular Formula: C₁₁H₁₂O₅
• Beilstein: 10,508
• Solubility Information: Solubility in water: insoluble in water. Other solubilities: soluble in methanol,ethanol and acetone
• SMILES: COC1=CC(=CC(=C1O)OC)C=CC(=O)O
• Molecular Weight (g/mol): 224.21
• ChEBI: CHEBI:15714
• Percent Purity: 98%
• Chemical Name or Material: 3, 5-Dimethoxy-4-hydroxycinnamic acid

Safety and Handling

GHS H Statement:
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.

GHS P Statement:
Avoid breathing dust/fume/gas/mist/vapors/spray.
IF ON SKIN: Wash with plenty of soap and water.
Wear protective gloves/protective clothing/eye protection/face protection.
IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

WARNING: The information provided on this web site was developed in compliance with European Union (EU) regulations and is correct to the best of our knowledge, information and belief at the date of its publication. The information given is designed only as a guide for safe handling and use. It is not to be considered as either a warranty or quality specification.

GHS Signal Word: Warning

missing translation for 'einecsNumber' : 208-487-3

Product Identifier

• 3,5-Dimethoxy-4-hydroxycinnamic acid, predominantly trans isomer

Signal Word

• Warning

Hazard Category

• Serious eye damage/eye irritation Category 2
• Skin corrosion/irritation Category 2
• Specific target organ toxicity Category 3

Hazard Statement

• H319-Causes serious eye irritation.
• H335-May cause respiratory irritation.
• H315-Causes skin irritation.

Precautionary Statement

• P261-Avoid breathing dust/fume/gas/mist/vapours/spray.
• P280-Wear protective gloves/protective clothing/eye protection/face protection.
• P302+P352-IF ON SKIN: Wash with plenty of water/.
• P305+P351+P338-IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

RUO – Research Use Only