tetrapropylgermane

• ChemBase ID: 138350
• Molecular Formular: C12H28Ge
• Molecular Mass: 244.99072
• Monoisotopic Mass: 246.1402779
• SMILES: CCC[Ge](CCC)(CCC)CCC
• Canonical SMILES: CCC[Ge](CCC)(CCC)CCC
• InChI: InChI=1S/C12H28Ge/c1-5-9-13(10-6-2,11-7-3)12-8-4/h5-12H2,1-4H3
• InChIKey: XSYFWJCOPKYIQN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetrapropylgermane
• IUPAC Traditional name: germane, tetrapropyl-
• Synonyms: Tetrapropylgermanium; 四丙基锗

Database IDs

• CAS Number: 994-65-0
• EC Number: 213-620-3
• MDL Number: MFCD00015195
• PubChem SID: 162232606; 24868348
• PubChem CID: 13824

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.7864
• LogD (pH = 7.4): 3.7864
• Log P: 3.7864
• Molar Refractivity: 59.4836 cm^3
• Polarizability: 26.929451 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 86-87 °C/5 mmHg(lit.)
• Flash Point: 190.4 °F; 88 °C
• Density: 0.946 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.452(lit.)
• Vapor Pressure: 29 mmHg ( 100 °C)

Safety Information

• RTECS: LY5120000
• European Hazard Symbols: Harmful (Xn)
• German water hazard class: 3
• Risk Statements: 20/21/22
• Safety Statements: 36
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H312-H332
• GHS Precautionary statements: P280
• 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%
• Linear Formula: (CH3CH2CH2)4Ge