Dibutyltin Diacetate - ≥95%(W) , CAS No.1067-33-0

CAS: 1067-33-0 Cat. No.: D155023 Molecular Weight: 351.03 EC Number: 213-928-8

GRADE & PURITY ≥95%(W)

Synonyms

BAA06733 | F88278 | Metacure T-1 | Dibutylstannium diacetate | SB12380 | MFCD00008697 | J-001638 | DIBUTYLTIN DIACETATE [HSDB] | A801493 | EINECS 213-928-8 | NCGC00164363-02 | DTXCID30419 | NCGC00164363-01 | Bis(acetato)dibutyltin | Diacetoxydibutlyltin |

Storage

Argon charged,Room temperature

Shipped In

Normal

Overview

As as stabilizer in chlorinated organics, and as a catalyst for condensation reactions.

Specifications

Synonyms

BAA06733 | F88278 | Metacure T-1 | Dibutylstannium diacetate | SB12380 | MFCD00008697 | J-001638 | DIBUTYLTIN DIACETATE [HSDB] | A801493 | EINECS 213-928-8 | NCGC00164363-02 | DTXCID30419 | NCGC00164363-01 | Bis(acetato)dibutyltin | Diacetoxydibutlyltin |

Specifications & Purity

≥95%(W)

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥95%(W)

Names and Identifiers

• Pubchem Sid: 504768484
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504768484
• Canonical Smiles: CCCC[Sn](CCCC)(OC(=O)C)OC(=O)C
• IUPAC Name: [acetyloxy(dibutyl)stannyl] acetate
• InChIKey: JJLKTTCRRLHVGL-UHFFFAOYSA-L
• INCHI: 1S/2C4H9.2C2H4O2.Sn/c2*1-3-4-2;2*1-2(3)4;/h2*1,3-4H2,2H3;2*1H3,(H,3,4);/q;;;;+2/p-2
• Isomeric SMILES: CCCC[Sn](CCCC)(OC(=O)C)OC(=O)C
• RTECS: WH6880000
• UN Number: 2922
• Packing Group: II
• Molecular Weight: 351.03
• Reaxy-Rn: 4136035
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4136035&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Carboxylic acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Carboxylic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acids
• Alternative Parents: Monocarboxylic acids and derivatives Organotin compounds Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Monocarboxylic acid or derivatives - Carboxylic acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organotin compound - Organooxygen compound - Organometallic compound - Organic post-transition metal moeity - Carbonyl group - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as carboxylic acids. These are compounds containing a carboxylic acid group with the formula -C(=O)OH.
• External Descriptors: Not available

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

• Solubility: Soluble in water and most organic solvents, Soluble in water and most organic solvents
• Sensitivity: Light Sensitive,Moisture Sensitive
• Refractive Index: 1.471
• Flash Point(°F): 143°C
• Flash Point(°C): 143°C
• Boil Point(°C): 145°C
• Melt Point(°C): 7-10°C
• Molecular Weight: 351.030 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 10
• Exact Mass: 352.07 Da
• Monoisotopic Mass: 352.07 Da
• Topological Polar Surface Area: 52.600 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 227.000
• 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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