(2-aminoethyl)[3-(triethoxysilyl)propyl]amine

• ChemBase ID: 180116
• Molecular Formular: C11H28N2O3Si
• Molecular Mass: 264.43712
• Monoisotopic Mass: 264.1869193
• SMILES: [Si](OCC)(OCC)(OCC)CCCNCCN
• Canonical SMILES: NCCNCCC[Si](OCC)(OCC)OCC
• InChI: InChI=1S/C11H28N2O3Si/c1-4-14-17(15-5-2,16-6-3)11-7-9-13-10-8-12/h13H,4-12H2,1-3H3
• InChIKey: INJVFBCDVXYHGQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-aminoethyl)[3-(triethoxysilyl)propyl]amine
• IUPAC Traditional name: (2-aminoethyl)[3-(triethoxysilyl)propyl]amine
• Synonyms: N-(2-Aminoethyl)-3-aminopropyltriethoxysilane; N1-(3-(Triethoxysilyl)propyl)ethane-1,2-diamine

Database IDs

• CAS Number: 5089-72-5
• MDL Number: MFCD00138097
• PubChem SID: 164236026
• PubChem CID: 78772

CALCULATED PROPERTIES

• H Acceptors: 5
• H Donor: 2
• LogD (pH = 5.5): -4.607545
• LogD (pH = 7.4): -2.1216373
• Log P: 0.5081
• Molar Refractivity: 66.3752 cm^3
• Polarizability: 29.06172 Å^3
• Polar Surface Area: 65.74 Å^2
• Rotatable Bonds: 12
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%