(2-aminoethyl)(propyl)amine; silanone

• ChemBase ID: 146603
• Molecular Formular: C5H16N2OSi
• Molecular Mass: 148.27884
• Monoisotopic Mass: 148.10318967
• SMILES: CCCNCCN.O=[SiH2]
• Canonical SMILES: CCCNCCN.[SiH2]=O
• InChI: InChI=1S/C5H14N2.H2OSi/c1-2-4-7-5-3-6;1-2/h7H,2-6H2,1H3;2H2
• InChIKey: RTSSTXAEEVVOBI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-aminoethyl)(propyl)amine; silanone
• IUPAC Traditional name: (2-aminoethyl)(propyl)amine; silicon monoxide
• Synonyms: Diamine-3 functionalized silica gel; 3-(Ethylenediamino)propyl-functionalized silica gel; 二胺-3 官能化硅胶; 3-(乙二胺基)丙基硅胶

Database IDs

• CAS Number: 1173023-01-2
• MDL Number: MFCD03095961
• PubChem SID: 162240797; 24878255
• PubChem CID: 16217003

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -4.958245
• LogD (pH = 7.4): -2.988919
• Log P: -0.11053193
• Molar Refractivity: 31.9158 cm^3
• Polarizability: 13.012255 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26-36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves
• Storage Temperature: 2-8°C

Product Information

• Particle Size: 200-400 mesh
• Pore Size: 60 Å pore size
• Surface Area: 500 m2/g
• Extent of Labeling: 1.4 mmol/g loading

DETAILS

Sigma Aldrich - 537918

Application
Metal Scavenger: Zn, Ni(II), Pb, Cd, and Hg
Packaging
5, 25, 100 g in glass bottle