tributyl(chloro)stannane

• ChemBase ID: 80369
• Molecular Formular: C12H27ClSn
• Molecular Mass: 325.49678
• Monoisotopic Mass: 326.08232254
• SMILES: Cl[Sn](CCCC)(CCCC)CCCC
• Canonical SMILES: CCCC[Sn](CCCC)(CCCC)Cl
• InChI: InChI=1S/3C4H9.ClH.Sn/c3*1-3-4-2;;/h3*1,3-4H2,2H3;1H;/q;;;;+1/p-1
• InChIKey: GCTFWCDSFPMHHS-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: tributyl(chloro)stannane
• IUPAC Traditional name: tin-san
• Synonyms: Chlorotributyltin; Tributyltin chloride; Chlorotributylstannane; TBTC; Tributylchlorotin; Tributyltin chloride; TBTC; 氯化三丁基锡; 三丁基氯化锡; 三丁基氯化锡

Database IDs

• CAS Number: 1461-22-9
• EC Number: 215-958-7
• MDL Number: MFCD00000521
• Beilstein Number: 3535715
• PubChem SID: 24869118; 24868030; 24900253; 162067489
• PubChem CID: 15096

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 4.5294
• LogD (pH = 7.4): 4.5294
• Log P: 4.5294
• Molar Refractivity: 65.014 cm^3
• Polarizability: 30.028944 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -19°C
• Boiling Point: 171-173 °C/25 mmHg(lit.); 171-173°C/25mm
• Flash Point: 113 °C; 120°C; 235.4 °F
• Density: 1.186; 1.2 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.492; n20/D 1.492(lit.)
• Vapor Pressure: <0.01 mmHg ( 20 °C)

Safety Information

• Storage Warning: Toxic/Moisture Sensitive/Store under Argon
• RTECS: WH6820000
• European Hazard Symbols: Nature polluting (N); Toxic (T)
• UN Number: 2788
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 3
• Risk Statements: 21-25-36/38-48/23/25-50/53
• Safety Statements: 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
• Personal Protective Equipment: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 2788 6.1/PG 3
• Storage Temperature: 2-8°C

Product Information

• Purity: ≥95.0% (AT); 96%
• Grade: analytical standard; PESTANAL®, analytical standard; purum
• Packaging: ampule of 500 mg
• Linear Formula: [CH3(CH2)3]3SnCl

DETAILS

Sigma Aldrich - T50202

Packaging
5, 100, 500 g in glass bottle

Sigma Aldrich - 45713

Legal Information
PESTANAL is a registered trademark of Sigma-Aldrich Laborchemikalien GmbH