tributylgermane

• ChemBase ID: 147974
• Molecular Formular: C12H28Ge
• Molecular Mass: 244.99072
• Monoisotopic Mass: 246.1402779
• SMILES: CCCC[GeH](CCCC)CCCC
• Canonical SMILES: CCCC[GeH](CCCC)CCCC
• InChI: InChI=1S/C12H28Ge/c1-4-7-10-13(11-8-5-2)12-9-6-3/h13H,4-12H2,1-3H3
• InChIKey: KTSWILXIWHVQLR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tributylgermane
• IUPAC Traditional name: tributylgermane
• Synonyms: Tributylgermanium hydride; Tri-n-butylgermanium hydride; 三正丁基氢化锗

Database IDs

• CAS Number: 998-39-0
• MDL Number: MFCD00077987
• PubChem SID: 24865626; 162242154
• PubChem CID: 6327830

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.7027
• LogD (pH = 7.4): 3.7027
• Log P: 3.7027
• Molar Refractivity: 59.2157 cm^3
• Polarizability: 26.929451 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid
• Boiling Point: 123 °C/20 mmHg(lit.); 123°C/20mn
• Flash Point: 113 °C; 235.4 °F
• Density: 0.92; 0.949 g/mL at 25 °C(lit.)
• Refractive Index: 1.4508; n20/D 1.45(lit.)

Safety Information

• Storage Warning: Air & Moisture Sensitive
• European Hazard Symbols: X; Harmful (Xn)
• German water hazard class: 3
• Risk Statements: 20/21/22-41; 22-36/37/38
• Safety Statements: 26-36; 26-36/37
• TSCA Listed: 否
• GHS Pictograms: GHS05; GHS06; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H315-H319-H335; H302-H312-H318-H332
• GHS Precautionary statements: P261-P301+P310-P305+P351+P338-P302+P352-P405-P501A; P280-P305 + P351 + P338
• Personal Protective Equipment: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Product Information

• Purity: 97+%; 99%
• Linear Formula: [CH3(CH2)3]3GeH

DETAILS

Sigma Aldrich - 409170

General description
Atomic number of base material: 32 Germanium
Packaging
1 g in glass bottle
Application
Efficient reducing agent for benzylic chlorides.1