tetrakis(2H9)butylstannane

• ChemBase ID: 135046
• Molecular Formular: C16H36Sn
• Molecular Mass: 347.15804
• Monoisotopic Mass: 348.18389515
• SMILES: CCCC[Sn](CCCC)(CCCC)CCCC
• Canonical SMILES: CCCC[Sn](CCCC)(CCCC)CCCC
• InChI: InChI=1S/4C4H9.Sn/c4*1-3-4-2;/h4*1,3-4H2,2H3
• InChIKey: AFCAKJKUYFLYFK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tetrakis(^2H₉)butylstannane
• IUPAC Traditional name: tetrakis(^2H₉)butylstannane
• Synonyms: Tetrabutyl-d36-tin; 四丁基锡-d36

Database IDs

• MDL Number: MFCD01861650
• PubChem SID: 162229321
• PubChem CID: 71309049

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 7.9216
• LogD (pH = 7.4): 7.9216
• Log P: 7.9216
• Molar Refractivity: 77.8876 cm^3
• Polarizability: 35.49263 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 12
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Boiling Point: 145 °C(lit.)
• Flash Point: 107 °C; 224.6 °F
• Density: 1.165 g/mL at 25 °C
• Mass Shift: M+36

Safety Information

• European Hazard Symbols: Nature polluting (N); Toxic (T)
• German water hazard class: 3
• Risk Statements: 21-25-36/38-48/23/25-50/53
• Safety Statements: 35-36/37/39-45-60-61
• GHS Pictograms: GHS06; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H312-H315-H319-H372-H410
• GHS Precautionary statements: P273-P280-P301 + P310-P305 + P351 + P338-P314-P501

Product Information

• Purity: 98% (CP)
• Isotopic Purity: 98 atom % D
• Mol. Weight: mol wt 382.67 by atom % calculation
• Linear Formula: (CD3CD2CD2CD2)4Sn

DETAILS

Sigma Aldrich - 617016

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.