[3-(dimethylamino)propyl](2-methoxyethyl)amine

• ChemBase ID: 257201
• Molecular Formular: C8H20N2O
• Molecular Mass: 160.2572
• Monoisotopic Mass: 160.15756327
• SMILES: N(CCCNCCOC)(C)C
• Canonical SMILES: COCCNCCCN(C)C
• InChI: InChI=1S/C8H20N2O/c1-10(2)7-4-5-9-6-8-11-3/h9H,4-8H2,1-3H3
• InChIKey: ZRBJURRZDDZZAK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [3-(dimethylamino)propyl](2-methoxyethyl)amine
• IUPAC Traditional name: [3-(dimethylamino)propyl](2-methoxyethyl)amine
• Synonyms: N'-(2-methoxyethyl)-N,N-dimethylpropane-1,3-diamine

Database IDs

• CAS Number: 84176-68-1
• MDL Number: MFCD11099617
• PubChem SID: 164313111
• PubChem CID: 3019741

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -5.5243926
• LogD (pH = 7.4): -3.148888
• Log P: -0.16124971
• Molar Refractivity: 48.6214 cm^3
• Polarizability: 19.213655 Å^3
• Polar Surface Area: 24.5 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.389

Product Information

• Purity: 95%