(2-azidoethyl)bis(2-methoxyethyl)amine

• ChemBase ID: 241391
• Molecular Formular: C8H18N4O2
• Molecular Mass: 202.25412
• Monoisotopic Mass: 202.14297584
• SMILES: [N+](=[N-])=NCCN(CCOC)CCOC
• Canonical SMILES: COCCN(CCN=[N+]=[N-])CCOC
• InChI: InChI=1S/C8H18N4O2/c1-13-7-5-12(6-8-14-2)4-3-10-11-9/h3-8H2,1-2H3
• InChIKey: QEFWGUBOFXEXSJ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-azidoethyl)bis(2-methoxyethyl)amine
• IUPAC Traditional name: (2-azidoethyl)bis(2-methoxyethyl)amine
• Synonyms: (2-azidoethyl)bis(2-methoxyethyl)amine

Database IDs

• MDL Number: MFCD14662302
• PubChem SID: 164297301
• PubChem CID: 61418547

CALCULATED PROPERTIES

• H Acceptors: 5
• H Donor: 0
• LogD (pH = 5.5): -2.4120932
• LogD (pH = 7.4): -0.64241666
• Log P: 0.22646087
• Molar Refractivity: 54.6599 cm^3
• Polarizability: 20.67925 Å^3
• Polar Surface Area: 51.13 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.97

Product Information

• Purity: 95%