Bis(tributyltin) oxide - analytical standard , CAS No.56-35-9

CAS: 56-35-9 Cat. No.: T107352 Molecular Weight: 596.1 Beilstein Registry Number: 745057 EC Number: 200-268-0 PubChem CID: 16682746

GRADE & PURITY Analytical standard

Synonyms

Bis-(tri-n-butylcin)oxid | OTBE | OTBE [French] | Oxybis(tributyltin) | Oxybis[tributylstannane] | SCHEMBL9470441 | AMY25031 | APQHKWPGGHMYKJ-UHFFFAOYSA- | Bis(tri-n-butyltin)oxide, technical grade | Distannoxane, 1,1,1,3,3,3-hexabutyl- | Lastanox F | Sta

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Overview

Employed in the synthesis of α,β-unsaturated methyl ketones， isoxazoles, fungicides, and bactericides.

Specifications

Synonyms

Bis-(tri-n-butylcin)oxid | OTBE | OTBE [French] | Oxybis(tributyltin) | Oxybis[tributylstannane] | SCHEMBL9470441 | AMY25031 | APQHKWPGGHMYKJ-UHFFFAOYSA- | Bis(tri-n-butyltin)oxide, technical grade | Distannoxane, 1, 1, 1, 3, 3, 3-hexabutyl- | Lastanox F | Sta

Specifications & Purity

analytical standard

Storage

Store at 2-8°C

Shipped In

Wet ice, FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Analytical standard

Names and Identifiers

• Canonical Smiles: CCCC[Sn](CCCC)(CCCC)O[Sn](CCCC)(CCCC)CCCC
• IUPAC Name: tributyl(tributylstannyloxy)stannane
• InChIKey: APQHKWPGGHMYKJ-UHFFFAOYSA-N
• INCHI: 1S/6C4H9.O.2Sn/c6*1-3-4-2;;;/h6*1,3-4H2,2H3
• Isomeric SMILES: CCCC[Sn](CCCC)(CCCC)O[Sn](CCCC)(CCCC)CCCC
• WGK Germany: 3
• RTECS: JN8750000
• PubChem CID: 16682746
• UN Number: 2788
• Packing Group: I
• Molecular Weight: 596.1
• Beilstein: 745057

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organo-post-transition metal compounds
      • Subclass Organotin compounds
        • Level5 Triorganotin compounds
          • Level6 Trialkyltins

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organo-post-transition metal compounds
• Subclass: Organotin compounds
• Intermediate Tree Nodes: Triorganotin compounds
• Direct Parent: Trialkyltins
• Alternative Parents: Organic tin salts Organic oxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkyltin - Organic metal salt - Organic oxygen compound - Hydrocarbon derivative - Organic tin salt - Organic salt - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as trialkyltins. These are triorganotin compounds where the tin atom is linked to exactly three alkyl groups.
• External Descriptors: inorganic molecular entity

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: Air & Moisture Sensitive
• Refractive Index: 1.486
• Flash Point(°C): 190°C
• Boil Point(°C): 180°C
• Molecular Weight: 596.100 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 20
• Exact Mass: 596.221 Da
• Monoisotopic Mass: 598.222 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 27
• Formal Charge: 0
• Complexity: 246.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

XLogP3

References

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