270229

3-Methoxyphenethylamine

97%

• Synonym(s): 2-(3-Methoxyphenyl)ethylamine
• Linear Formula: CH₃OC₆H₄CH₂CH₂NH₂
• CAS Number: 2039-67-0
• Molecular Weight: 151.21
• Beilstein: 775202
• EC Number: 218-017-9
• MDL number: MFCD00008187
• UNSPSC Code: 12352100
• PubChem Substance ID: 24856363
• NACRES: NA.22

Properties

• Quality Level: 100
• Assay: 97%
• form: liquid
• refractive index: n20/D 1.538 (lit.)
• bp: 118-119 °C/6 mmHg (lit.)
• density: 1.038 g/mL at 25 °C (lit.)
• functional group: amine
• SMILES string: COc1cccc(CCN)c1
• InChI: 1S/C9H13NO/c1-11-9-4-2-3-8(7-9)5-6-10/h2-4,7H,5-6,10H2,1H3
• InChI key: WJBMRZAHTUFBGE-UHFFFAOYSA-N

Description

General description

The spectral binding affinity for 3-methoxyphenethylamine was studied to examine the determinants of P450 2D6 catalysis.

Application

3-Methoxyphenethylamine was used in the perfluorooctanesulfonic acid catalyzed Pictet-Spengler reaction. It was also used in the synthesis of 1,3-oxazepines via palladium-catalyzed intramolecular coupling.

Safety Information

• Pictograms: GHS05
• Signal Word: Danger
• Hazard Statements: H314
• Precautionary Statements: P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 - P363 - P405
• Hazard Classifications: Skin Corr. 1B
• Storage Class Code: 8A - Combustible corrosive hazardous materials
• WGK: WGK 3
• Flash Point(F): 230.0 °F - closed cup
• Flash Point(C): 110 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves