Basic information
- Standard SMILES
CCC[CH2][Sn]([CH2]CCC)([CH2]CCC)[c]1ccccc1- InChIKey
SYUVAXDZVWPKSI-UHFFFAOYSA-N- Molecular formula
- C18H32Sn
- Average molar mass
- 367.2 g/mol
- Monoisotopic mass
- 368.15259572
Overview
See also: Tri-n-butylphenyltin;Tributylphenyltin (annotation moved to).
Names & identifiers
- Preferred name
- Tributylphenyltin
- IUPAC
- tributyl(phenyl)stannane
- English name
- Tributylphenyltin
- Molecular formula
- C18H32Sn
- Molecular weight
- 367.16
Names & synonyms
TributylphenyltinPhenyltributylstannanePhenyltributyltinStannane, tributylphenylRefChem:899140tributyl(phenyl)stannane960-16-7TributylphenylstannaneStannane, tributylphenyl-Phenyltri-n-butyltinPhenyltributylstannane; Phenyltributyltin; Tri-n-butylphenyltintributylstannylbenzene
Show more names
SKL976Tributyl(phenyl)tri-n-butylphenyltinTributylphenyltin(IV)Tributylphenyltin 10GRTributyl-phenyl-stannane
Stannane,tributylphenyl-tri-n-butylphenylstannanephenyltributlytintributylphenyl tinphenyl tnbutyl tinphenyl tributyl tinPhSnBu3tributyl phenyl tin
Database identifiers
- CAS
960-16-7- PubChem CID
- 607632
- DTXSID
DTXSID30242077- Nikkaji
- J146.701H
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 10
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 184
Experimental & physicochemical properties
Chemical ClassesMetals -> Tin Compounds, Organic
Physical DescriptionClear colorless liquid; [Sigma-Aldrich MSDS]
Physicochemical properties
- Melting point
- 0 °C · <0°C
- Boiling point
- 125 · 125-128 °C/0.14 mmHg (lit.)
- Density
- 1.125 g/mL · 1.125 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.516(lit.)
- Flash point
- 230 °F · >230 °F
- storage temp.
- -20 °C · Storage temp. -20°C
- solubility
- Sparingly Soluble (9.9E-5 g/L) (25°C)
- form
- Oil
- color
- Colourless to Light Yellow
- Specific Gravity
- 1.125 · 1.125
- Hydrolytic Sensitivity
- 4 · 4: no reaction with water under neutral conditions
- BRN
- 3610571 · 3610571
- Stability
- Moisture Sensitive
- InChI
- 1S/C6H5.3C4H9.Sn/c1-2-4-6-5-3-1;3*1-3-4-2;/h1-5H;3*1,3-4H2,2H3;
- InChIKey
- SYUVAXDZVWPKSI-UHFFFAOYSA-N
- SMILES
- CCCC[Sn](CCCC)(CCCC)c1ccccc1
- UNSPSC Code
- 12352103 · 12352103
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 6 · GHS06,GHS08,GHS09
- Signal word
- Danger
- Hazard statements
- 301 · H301-H312-H315-H319-H360FD-H372-H410
- Precautionary statements
- 202 · P202-P273-P280-P301+P310-P302+P352+P312-P305+P351+P338
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- T,N
- Risk Statements
- 21 · 21-25-36/38-48/23/25-50/53
- Safety Statements
- 35 · 35-36/37/39-45-60-61
- RIDADR
- 2788 · UN 2788 6.1/PG 3
- WGK Germany
- 3 · 3
- TSCA
- No
- HazardClass
- 6.1 · 6.1(a)
- PackingGroup
- II
- HS Code
- 29319090 · 29319090
- Storage Class
- 6.1 C · 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard Classifications
- 3 OralAcute · Acute Tox. 3 OralAcute Tox. 4 DermalAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Repr. 1BSkin Irrit. 2STOT RE 1
Safety & regulation
Hazard information
Hazards SummaryA skin and strong eye irritant; Toxic by ingestion; Harmful by skin absorption; Prolonged or repeated exposure may cause organ injury; [Sigma-Aldrich MSDS] See Tetraethyl tin and Tetra-n-butyltin.
Safety & protection
Exposure Control and Personal Protection0.1 [mg/m3], inhalable fraction, as Sn[German Research Foundation (DFG)]
Threshold Limit Values (TLV)
0.1 [mg/m3], as Sn
0.2 [mg/m3], as Sn
Permissible Exposure Limit (PEL)0.1 [mg/m3], as Sn
Immediately Dangerous to Life or Health (IDLH)25.0 [mg/m3], as Sn
Toxicology
Adverse EffectsNeurotoxin - Other CNS neurotoxin
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- No
- ridadr
- UN 2788 6.1/PG 3
- hs_code
- 29319090
- risk_code
- 21-25-36/38-48/23/25-50/53
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS08,GHS09
- hazard_code
- T,N
- safety_code
- 35-36/37/39-45-60-61
- hazard_class
- 6.1(a)
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- packing_group
- II
- Hazard statements
- H301-H312-H315-H319-H360FD-H372-H410
- Hazard Classifications
- Acute Tox. 3 OralAcute Tox. 4 DermalAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Repr. 1BSkin Irrit. 2STOT RE 1
- Precautionary statements
- P202-P273-P280-P301+P310-P302+P352+P312-P305+P351+P338
Chemistry & industry
Applications
UsesIt is applied in chemical research.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers50 total
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Related reactions
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