2-methoxy-N-methyl-N-phenylbenzamide

• ChemBase ID: 299364
• Molecular Formular: C15H15NO2
• Molecular Mass: 241.2851
• Monoisotopic Mass: 241.11027873
• SMILES: COc1c(C(=O)N(c2ccccc2)C)cccc1
• Canonical SMILES: COc1ccccc1C(=O)N(c1ccccc1)C
• InChI: InChI=1S/C15H15NO2/c1-16(12-8-4-3-5-9-12)15(17)13-10-6-7-11-14(13)18-2/h3-11H,1-2H3
• InChIKey: FVWCQHOIQFNYMV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-methoxy-N-methyl-N-phenylbenzamide
• IUPAC Traditional name: 2-methoxy-N-methyl-N-phenylbenzamide
• Synonyms: 2-Methoxy-N-methyl-N-phenylbenzamide

Database IDs

• CAS Number: 7022-48-2
• MDL Number: MFCD01611816
• PubChem SID: 180684895
• PubChem CID: 17612119

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 2.7715254
• LogD (pH = 7.4): 2.7715254
• Log P: 2.7715254
• Molar Refractivity: 71.1706 cm^3
• Polarizability: 27.300571 Å^3
• Polar Surface Area: 29.54 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26-37-60
• TSCA Listed: 否
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501

Product Information

• Purity: 97%