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994-89-8

994-89-8 Structure

994-89-8 Structure
IdentificationMore
[Name]

TRIBUTYLSTANNYLACETYLENE
[CAS]

994-89-8
[Synonyms]

ETHYNYLTRIBUTYLSTANNANE
ETHYNYLTRIBUTYLTIN
ETHYNYLTRI-N-BUTYLTIN
TRIBUTYLETHYNYLSTANNANE
TRIBUTYL(ETHYNYL)TIN
TRIBUTYLSTANNYLACETYLENE
TRI-N-BUTYLETHYNYLTIN
TRI-N-BUTYLSTANNYLACETYLENE
TribuTylTin aceTylene
Ethynyltri-n-butylstannane~Tri-n-butyl(ethynyl)tin~Tri-n-butylstannylacetylene
Ethynyltri-n-butyltin,97%
ethynyltri-n-butylstannane
ETHYNYLTRIBUTYLIN
ethenyltributyltin
[EINECS(EC#)]

628-819-4
[Molecular Formula]

C14H28Sn
[MDL Number]

MFCD00009420
[Molecular Weight]

315.08
[MOL File]

994-89-8.mol
Chemical PropertiesBack Directory
[Appearance]

clear colourless liquid
[Boiling point ]

70 °C0.2 mm Hg(lit.)
[density ]

1.089 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.476(lit.)
[Fp ]

165 °F
[storage temp. ]

2-8°C
[form ]

liquid
[Specific Gravity]

1.089
[Water Solubility ]

Not miscible or difficult to mix with water.
[Sensitive ]

Moisture Sensitive
[BRN ]

3537659
[InChI]

InChI=1S/3C4H9.C2H.Sn/c3*1-3-4-2;1-2;/h3*1,3-4H2,2H3;1H;
[InChIKey]

YEMJHNYABQHWHL-UHFFFAOYSA-N
[SMILES]

[Sn](CCCC)(CCCC)(CCCC)C#C
[CAS DataBase Reference]

994-89-8(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

T,N
[Risk Statements ]

R21:Harmful in contact with skin.
R25:Toxic if swallowed.
R36/38:Irritating to eyes and skin .
R48/23/25:Toxic: danger of serious damage to health by prolonged exposure through inhalation and if swallowed .
R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
[Safety Statements ]

S35:This material and its container must be disposed of in a safe way .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S60:This material and/or its container must be disposed of as hazardous waste .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
[RIDADR ]

UN 2788 6.1/PG 3
[WGK Germany ]

3
[F ]

21
[TSCA ]

No
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29319090
Hazard InformationBack Directory
[Chemical Properties]

clear colorless liquid
[Uses]

Used to prepare vinylstannanes and stannylisoxazoles. Ethynylation reagent for azaaromatics.
[Purification Methods]

Purify it by dissolving the reagent (ca 50g) in heptane (250mL), washing it with H2O (100mL), drying (MgSO4), evaporating and distilling in a vacuum. It has IR: max 3280 ( C), 2950, 2850, 2005 (CC), 1455, 1065 and 865cm-1. [Bottaro et al. J Org Chem 46 5221 1981, Stille & Simpson J Am Chem Soc 109 2138 1987, Zavgorodnii et al. J Gen Chem USSR (Engl Edn) 37 1469 1967.]
Spectrum DetailBack Directory
[Spectrum Detail]

TRIBUTYLSTANNYLACETYLENE(994-89-8)1HNMR
TRIBUTYLSTANNYLACETYLENE(994-89-8)IR
TRIBUTYLSTANNYLACETYLENE(994-89-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Tributylethynylstannane, 95%(994-89-8)
[Alfa Aesar]

Ethynyltri-n-butyltin, 96%(994-89-8)
[Sigma Aldrich]

994-89-8(sigmaaldrich)
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