ethyl 2-[(2-methoxyethyl)amino]acetate

• ChemBase ID: 258484
• Molecular Formular: C7H15NO3
• Molecular Mass: 161.1989
• Monoisotopic Mass: 161.10519335
• SMILES: C(=O)(OCC)CNCCOC
• Canonical SMILES: COCCNCC(=O)OCC
• InChI: InChI=1S/C7H15NO3/c1-3-11-7(9)6-8-4-5-10-2/h8H,3-6H2,1-2H3
• InChIKey: CAFRQFYFJDTUNI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: ethyl 2-[(2-methoxyethyl)amino]acetate
• IUPAC Traditional name: ethyl 2-[(2-methoxyethyl)amino]acetate
• Synonyms: ethyl [(2-methoxyethyl)amino]acetate

Database IDs

• MDL Number: MFCD11150212
• PubChem SID: 164314394
• PubChem CID: 15818815

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -0.7924779
• LogD (pH = 7.4): -0.27218992
• Log P: -0.25916865
• Molar Refractivity: 41.3392 cm^3
• Polarizability: 16.639622 Å^3
• Polar Surface Area: 47.56 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.272

Product Information

• Purity: 95%