Ethanamine, 2-[[(tributylstannyl)methyl]thio]- , CAS No.1452829-00-3

CAS: 1452829-00-3 Cat. No.: E1270272 Formula: C₁₅H₃₅NSSn Peso molecolare: 380.22 Numero EC: 809-159-8 PubChem CID: 71528623

Storage

Room temperature

Shipped In

Normal

Specifications

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Nomi e identificatori

• Sorrisi canonici: CCCC[Sn](CCCC)(CCCC)CSCCN
• IUPAC Name: 2-(tributylstannylmethylsulfanyl)ethanamine
• InChIKey: DYBMHPJDHUKXRF-UHFFFAOYSA-N
• INCHI: 1S/3C4H9.C3H8NS.Sn/c3*1-3-4-2;1-5-3-2-4;/h3*1,3-4H2,2H3;1-4H2
• Isomeri SMILES: CCCC[Sn](CCCC)(CCCC)CSCCN
• PubChem CID: 71528623
• Peso molecolare: 380.22

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Classe Organo-post-transition metal compounds
      • Subclass Organotin compounds
        • Level5 Tetraorganotin compounds
          • Level6 Tetraalkyltins

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Classe: Organo-post-transition metal compounds
• Subclass: Organotin compounds
• Intermediate Tree Nodes: Tetraorganotin compounds
• Direct Parent: Tetraalkyltins
• Alternative Parents: Sulfenyl compounds Dialkylthioethers Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tetraalkyltin - Dialkylthioether - Sulfenyl compound - Thioether - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Primary aliphatic amine - Amine - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as tetraalkyltins. These are tetraorganotin compounds where the tin atom is linked to exactly four alkyl groups.
• 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

Proprietà chimiche e fisiche

• Peso molecolare: 380.200 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 13
• Exact Mass: 381.151 Da
• Monoisotopic Mass: 381.151 Da
• Topological Polar Surface Area: 51.300 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 154.000
• 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

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