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2-TRIBUTYLSTANNYLBENZOTHIAZOLE is a chemical compound belonging to the benzothiazole family, characterized by its heat stabilizing properties and applications in various industrial processes.

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  • 105445-58-7 Structure
  • Basic information

    1. Product Name: 2-TRIBUTYLSTANNYLBENZOTHIAZOLE
    2. Synonyms: 2-TRIBUTYLSTANNYLBENZOTHIAZOLE;2-(Tributylstannyl)-1,3-benzothiazole;(1,3-Benzothiazol-2-yl)tributylstannane;Benzothiazole,2-(tributylstannyl)-;2-(tributylstannyl)benzo[d]thiazole;2-Tributylstannanylbenzothiazole
    3. CAS NO:105445-58-7
    4. Molecular Formula: C19H31NSSn
    5. Molecular Weight: 424.23
    6. EINECS: N/A
    7. Product Categories: Stannanes
    8. Mol File: 105445-58-7.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 424.1°C at 760 mmHg
    3. Flash Point: >110 °C
    4. Appearance: /
    5. Density: 1.202 g/mL at 25 °C
    6. Vapor Pressure: 5.22E-07mmHg at 25°C
    7. Refractive Index: N/A
    8. Storage Temp.: Keep Cold
    9. Solubility: N/A
    10. PKA: 0.89±0.10(Predicted)
    11. CAS DataBase Reference: 2-TRIBUTYLSTANNYLBENZOTHIAZOLE(CAS DataBase Reference)
    12. NIST Chemistry Reference: 2-TRIBUTYLSTANNYLBENZOTHIAZOLE(105445-58-7)
    13. EPA Substance Registry System: 2-TRIBUTYLSTANNYLBENZOTHIAZOLE(105445-58-7)
  • Safety Data

    1. Hazard Codes: Xi,T,N
    2. Statements: 21-25-36/38-48/23/25-50/53
    3. Safety Statements: 36/37/39-45-60-61
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: IRRITANT, KEEP COLD, TOXIC
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 105445-58-7(Hazardous Substances Data)

105445-58-7 Usage

Uses

Used in Plastics Industry:
2-TRIBUTYLSTANNYLBENZOTHIAZOLE is used as a heat stabilizer for the production of Polyvinyl Chloride (PVC), enhancing the material's thermal stability and preventing degradation during processing.
Used in Rubber Industry:
In the rubber industry, 2-TRIBUTYLSTANNYLBENZOTHIAZOLE serves as an inhibitor for the vulcanization process, controlling the rate of cross-linking and ensuring the desired properties of the final rubber product.
Used in Marine Coatings:
2-TRIBUTYLSTANNYLBENZOTHIAZOLE is utilized as a biocidal agent in antifouling paints, preventing the growth of marine organisms on ship hulls and other submerged structures, thus reducing drag and improving fuel efficiency.
Used in Agricultural Industry:
As a fungicide, 2-TRIBUTYLSTANNYLBENZOTHIAZOLE is applied in agriculture to protect crops from fungal infections, ensuring higher yields and crop quality.
However, due to its toxicity to aquatic organisms and potential reproductive and developmental toxicity, the use of 2-TRIBUTYLSTANNYLBENZOTHIAZOLE is regulated in certain countries and industries to minimize its environmental impact.

Check Digit Verification of cas no

The CAS Registry Mumber 105445-58-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,0,5,4,4 and 5 respectively; the second part has 2 digits, 5 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 105445-58:
(8*1)+(7*0)+(6*5)+(5*4)+(4*4)+(3*5)+(2*5)+(1*8)=107
107 % 10 = 7
So 105445-58-7 is a valid CAS Registry Number.
InChI:InChI=1/C7H4NS.3C4H9.Sn/c1-2-4-7-6(3-1)8-5-9-7;3*1-3-4-2;/h1-4H;3*1,3-4H2,2H3;/rC19H31NSSn/c1-4-7-14-22(15-8-5-2,16-9-6-3)19-20-17-12-10-11-13-18(17)21-19/h10-13H,4-9,14-16H2,1-3H3

105445-58-7SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,3-benzothiazol-2-yl(tributyl)stannane

1.2 Other means of identification

Product number -
Other names 2-Tributylstannanyl-benzothiazole

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:105445-58-7 SDS

105445-58-7Relevant articles and documents

Efficient one-pot cross-coupling of two aryl halides by stannylation/stille reaction in water under microwave irradiation

Tan, Xin,Zhou, Zi Jie,Zhang, Jia Xin,Duan, Xin Hong

, p. 5153 - 5157 (2014)

A simple and highly efficient one-pot approach has been developed for the Pd(PPh3)4-catalyzed cross-coupling of two different aryl or heteroaryl bromides/iodides. This method involves the combined use of microwave irradiation and water as a single solvent to achieve sequential stannylation and Stille cross-coupling reactions, which allows rapid access to a wide variety of biaryls in good to high yields. Furthermore, utilizing this step-economical protocol, 2,5-dibromopyridine was iteratively diarylated and the Boscalid intermediate was also synthesized in a one-pot manner. Copyright

Luminescent fluorene-based bis-pyrazolyl aniline ligand for aluminum detection

Frazer, Andrew,Morales, Alma R.,Woodward, Adam W.,Tongwa, Paul,Timofeeva, Tatiana,Belfield, Kevin D.

, p. 239 - 250 (2014)

The design, synthesis, and photophysical properties of a new fluorene-based fluorescent chemosensor, 4-((E)-2-(2-(benzo[d]thiazol-2-yl)-9,9-diethyl-9H- fluoren-7-yl)vinyl)-N,N-bis((3,5-dimethyl-1H-pyrazol-1-yl)methyl)benzenamine (AXF-Al), is described for the detection of Al3+. AXF-Al exhibited absorption at 382 nm and strong fluorescence emission at 542 nm (fluorescence quantum yield, Φ F, of 0.80). The capture of Al3+ by the pyrazolyl aniline receptor resulted in nominal change in the linear absorption (372 nm) but a large hypsochromic shift of 161 nm in the fluorescence spectrum (542 to 433 nm, Φ F = 0.88), from which Al3+ was detected both ratiometrically and colorimetrically. The addition of other metal ions, namely Mg2+, Ca2+, Mn2+, Fe 2+, Co2+, Ni2+, Cu2+, Zn 2+, Cd2+, Hg 2+ and Pb2+, produced only minimal changes in the optical properties of this probe. The emission band of this probe was also accessed by two-photon excitation in the near-IR, as two-photon absorption (2PA) is important for potential applications in two-photon fluorescence microscopy (2PFM) imaging. The 2PA cross section of the free fluorenyl ligand AXF-Al was 220 GM at 810 nm and 235 GM at 810 nm for the Al-ligand complex, practically useful properties for 2PFM.

Cationic Charge-Appended Abnormal Carbenes: Synthesis and Study of Electronically Modified Abnormal N-Heterocyclic Carbenes

Vanston, Catriona R.,Nicholls, Thomas P.,Bissember, Alex C.,Gardiner, Michael G.,Ho, Curtis C.

, p. 622 - 632 (2022/01/15)

A range of palladium complexes featuring electronically modified, imidazole-based abnormal N-heterocyclic carbene (aNHC) ligands have been prepared in the hopes of accessing a new class of cationic aNHC ligands electronically distinct from normal NHCs and aNHCs. These palladium complexes represent the first examples of transition metal-ligated aNHC complexes featuring a cationic moiety adjacent to the abnormal carbene center. It was anticipated that these design principles could facilitate electron transfer between the imidazolinylidene and the cationic heterocycle, thus reducing the electron density at the abnormal carbene center. However, this case study suggests that greater conformational restrictions that allow for heterocycle coplanarity are necessary to achieve significant electron transfer and enable access to a new class of cationic charge-appended aNHCs with unique electronic properties.

Platinum(II) complexes bearing 2-(9,9-dihexadecyl-7-R-fluoren-2-yl)-1,10- phenanthroline ligands: Synthesis, photophysics and reverse saturable absorption

Liu, Xu-Guang,Sun, Wenfang

supporting information, p. 4732 - 4742 (2013/09/24)

Six platinum(II) complexes bearing 2-(9,9-dihexadecyl-7-R-fluoren-2-yl)-1, 10-phenanthroline ligands (R = NO2, CN, I, H, benzothiazole, thiophene for ligands 1-6, respectively) were synthesized and their photophysics and reverse saturable absorption (RSA) were systematically investigated. All complexes exhibit intense absorption bands between 350 and 450 nm, which are attributed to 1π,π/1ILCT (intraligand charge transfer) transitions, and broad 1MLCT (metal to ligand charge transfer) transitions between 475 and 550 nm. All complexes are emissive at room temperature in a variety of solvents and at 77 K in butyronitrile glassy matrix, with the long-lived, structured emission appearing between 600 and 750 nm. The emitting states are assigned to predominantly the 3π, π* state with an admixture of 3MLCT characters. Upon ns laser excitation at 355 nm, all complexes display broad, moderately strong transient absorption from the visible to the near-IR region. As a result, RSA is observed from all complexes at 532 nm for ns laser pulses. The strength of the RSA for these complexes follows the trend: Pt-2 > Pt-3 > Pt-4 > Pt-1 >> Pt-5 > Pt-6, which correlates well with the trend of the estimated ΦTσex/σ0 values (where ΦT is the triplet excited state quantum yield, and σex and σ0 are the excited-state and ground-state absorption cross-section, respectively) at 532 nm. It is revealed that substitution at the 7-position of the fluorenyl component exerts a distinct effect on the photophysics and RSA of the complexes. Aromatic substituents such as benzothiazol-2-yl and 2-thionyl cause pronounced red-shifts of the absorption bands, the emission bands, and the transient difference absorption bands, but a decrease of the RSA at 532 nm. Platinum(II) complexes bearing 2-(9,9-dihexadecyl-7-R-fluoren-2-yl)-1,10-phenanthroline ligands exhibit a long-lived, broadband-absorbing excited state and strong reverse saturable absorption (RSA) at 532 nm for ns laser pulses. The substituent at the 7-position of the fluorenyl component exerts a pronounced effect on both the photophysical properties and the RSA. Copyright

SELECTIVE ESTROGEN RECEPTOR MODULATORS

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Page/Page column 120-121, (2008/06/13)

The present invention provides a compound represented by the following formula (I); [wherein T represents a single bond, a C1-C4 alkylene group which may have a substituent and the like; formula (I-1) represents a single bond or a double bond; A represents a single bond, a bivalent 5- to 14-membered heterocyclic group which may have a substituent and the like; Y represents a single bond and the like; Z represents a methylene group and the like; ring G represents a phenylene group and the like which may condense with a 5- to 6-membered ring and may have a heteroatom; Ra and Rb are the same as or different from each other and represent a hydrogen atom and the like; W represents a single bond and the like; R' represents 1 to 4 independent hydrogen atoms and the like; and R" represents 1 to 4 independent hydrogen atoms and the like] or a salt thereof, or a hydrate thereof.

HETEROCYCLIC COMPOUNDS

-

Page/Page column 15, (2008/06/13)

Compounds of formula I : and pharmaceutically-acceptable salts thereof, wherein Ar and R are as defined in the specification, compositions containing such compounds and the use of such compounds and compositions for use in therapy.

Organotin Biocides. XIII. C-Triorganostannylimidazoles, -benzoxazoles and -benzothiazoles

Molloy, Kieran C.,Waterfield, Philip C.,Mahon, Mary F.

, p. 61 - 74 (2007/10/02)

The synthesis, spectroscopic characterisation, and reactivity of a series of triorganotin imidazoles, benzothiazoles and benzoxazoles R3Sn(Het) (R=Me, Bu, Ph) are described.The structure of 2-(triphenylstannyl)benzothiazole has been determined by crystallographic methods.Space group: Triclinic, P1; a 9.501(1), b 10.172(2), c 13.231(2) Angstroem, β 70.46(1), γ 69.71(1) deg, U 1082.8 Angstroem3, F(000)=484, μ(Mo-Kα) 11.74 cm-1, R=0.0719 for 2264 reflections with I>3?I.The geometry at the tin is tetrahedral.Bond angles at tin are used to discuss the reactivity and Moessbauer spectra of these species.

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