(3-aminopropyl)({[(3-aminopropyl)dimethylsilyl]oxy})dimethylsilane

• ChemBase ID: 131616
• Molecular Formular: C10H28N2OSi2
• Molecular Mass: 248.51312
• Monoisotopic Mass: 248.17401659
• SMILES: C[Si](C)(CCCN)O[Si](C)(C)CCCN
• Canonical SMILES: NCCC[Si](O[Si](CCCN)(C)C)(C)C
• InChI: InChI=1S/C10H28N2OSi2/c1-14(2,9-5-7-11)13-15(3,4)10-6-8-12/h5-12H2,1-4H3
• InChIKey: GPXCORHXFPYJEH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3-aminopropyl)({[(3-aminopropyl)dimethylsilyl]oxy})dimethylsilane
• IUPAC Traditional name: (3-aminopropyl)({[(3-aminopropyl)dimethylsilyl]oxy})dimethylsilane
• Synonyms: 1,3-Bis(3-aminopropyl)-1,1,3,3-tetramethyldisiloxane; 3,3'-(1,1,3,3-Tetramethyldisiloxane-1,3-diyl)bis(propan-1-amine); 1,3-Bis(aminopropyl)tetramethyldisiloxane; 1,3-双(3-氨基丙基)-1,1,3,3-四甲基二硅氧烷; 1,3-双(氨丙烷基)四甲基二硅醚

Database IDs

• CAS Number: 2469-55-8
• EC Number: 219-588-7
• MDL Number: MFCD00039786
• Beilstein Number: 1760876
• PubChem SID: 162225893; 24848718
• PubChem CID: 17181

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -5.3644876
• LogD (pH = 7.4): -3.964737
• Log P: 1.4804
• Molar Refractivity: 61.6056 cm^3
• Polarizability: 28.757948 Å^3
• Polar Surface Area: 61.27 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 132 °C/11 mmHg(lit.); 132-139°C/11mm
• Flash Point: 195.8 °F; 91 °C; 91°C(195°F)
• Density: 0.897; 0.901 g/mL at 20 °C(lit.)
• Refractive Index: 1.4500; n20/D 1.451

Safety Information

• Storage Warning: Air Sensitive
• RTECS: JM9235000
• European Hazard Symbols: Corrosive (C)
• UN Number: 3267; UN2735
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2; II
• Risk Statements: 34
• Safety Statements: 26-28-36/37/39-45; 26-36/37/39-45
• TSCA Listed: 是
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314; H314-H227
• GHS Precautionary statements: P210-P260-P303+P361+P353-P305+P351+P338-P405-P501A; P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 3267 8/PG 2
• Storage Temperature: 2-8°C

Product Information

• Purity: ≥95.0% (T); 95+%; 97%
• Empirical Formula (Hill Notation): C10H28N2OSi2