Tributyltin isocyanate
Product Information
Molecular Formula
[CH3(CH2)3]3SnNCO
Molecular Weight
332.07
Description
Tributyltin isocyanate is a compound primarily used in the biomedical industry. It is utilized in the synthesis of potential antitumor or antiviral agents due to its ability to inhibit certain enzymes related to cancer or viral diseases. With its promising properties, Tributyltin isocyanate shows great potential in the development of new drugs for the treatment of various diseases.
Synonyms
tributyl(isocyanato)stannane; TRI-N-BUTYLISOCYANATOTIN; Stannane, (isocyanato)tributyl-; Tributylisocyanatostannane; Tributylstannyl isocyanate; Tri-n-butyltin isocyanate; Stannane, tributylisocyanato-; Tin, tributyl-, isothiocyanate
IUPAC Name
tributyl(isocyanato)stannane
SMILES
CCCC[Sn](CCCC)(CCCC)N=C=O
InChI
InChI=1S/3C4H9.CNO.Sn/c3*1-3-4-22-1-3/h3*1,3-4H2,2H3/q-1+1
InChI Key
YGUNDMHXMXDGII-UHFFFAOYSA-N
Boiling Point
297 °C (lit.)
Flash Point
230.0 °F - closed cup
Density
1.203 g/mL at 25 °C (lit.)
Storage
2-8°C
Refractive Index
n20/D 1.489 (lit.)
Safety Information
Hazards
H301 - H312 - H315 - H319 - H334 - H372 - H410
Precautionary Statement
P273 - P280 - P301 + P310 + P330 - P302 + P352 + P312 - P305 + P351 + P338
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
10
Exact Mass
333.111467 g/mol
Monoisotopic Mass
333.111467 g/mol
Topological Polar Surface Area
29.4Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
190
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2021004842-A1 | Polymerizable compositions for preparing polyisocyanurate-based plastics having extended worklife | 2019-07-08 |
| CN-114040934-A | Polymerizable composition for producing polyisocyanurate-based plastics having extended pot life | 2019-07-08 |
| TW-202003448-A | Adducts of amine catalysts for producing isocyanurate polymers | 2018-04-13 |
| WO-2019197638-A1 | Adducts of amine catalysts for producing isocyanurate polymers | 2018-04-13 |
| CN-112020525-A | Adducts of amine catalysts for making isocyanurate polymers | 2018-04-13 |
| EP-3774961-A1 | Adducts of amine catalysts for producing isocyanurate polymers | 2018-04-13 |
| US-2021238341-A1 | Adducts of amine catalysts for producing isocyanurate polymers | 2018-04-13 |
| CN-105801822-A | Liquid crystal polyester composition | 2016-04-13 |
| CN-105801823-A | Liquid crystal polyester composition | 2016-04-13 |
| CN-105860465-A | Liquid crystal polyester composition | 2016-04-13 |
