(2-ethoxyethyl)(ethyl)amine

• ChemBase ID: 13461
• Molecular Formular: C6H15NO
• Molecular Mass: 117.1894
• Monoisotopic Mass: 117.11536411
• SMILES: CCNCCOCC
• Canonical SMILES: CCNCCOCC
• InChI: InChI=1S/C6H15NO/c1-3-7-5-6-8-4-2/h7H,3-6H2,1-2H3
• InChIKey: HDWAEDOMCNQUSW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-ethoxyethyl)(ethyl)amine
• IUPAC Traditional name: (2-ethoxyethyl)(ethyl)amine
• Synonyms: (2-ethoxyethyl)(ethyl)amine; (2-Ethoxy-ethyl)-ethyl-amine

Database IDs

• CAS Number: 38256-95-0
• MDL Number: MFCD04035011
• PubChem SID: 160976768
• PubChem CID: 520890

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.7290332
• LogD (pH = 7.4): -1.8400309
• Log P: 0.47376192
• Molar Refractivity: 35.2341 cm^3
• Polarizability: 14.000582 Å^3
• Polar Surface Area: 21.26 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.69

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95%