Thiomorpholine - ≥98% , CAS No.123-90-0

CAS: 123-90-0 Cat. No.: T111124 Fórmula: C₄H₉NS Peso molecular: 103.19 Beilstein Registry Number: 102550 Número CE: 204-660-2 PubChem CID: 67164

GRADE & PURITY ≥98%

Synonyms

3A8R61G6QV | T-3790 | THIAMORPHOLINE [MI] | EN300-33437 | 1,4-Thiazane | F2158-0924 | CHEBI:36392 | STL193989 | SB12744 | SY033134 | HY-W007359 | Tetrahydro-1,4-thiazine | Thiazolidinane | AKOS005137922 | AS-17826 | 4-thiomorpholine | 1-Thia-4-azacyclohex

Storage

Room temperature,Argon charged

Shipped In

Normal

Visão geral

Thiomorpholine forms complexes with Cu(II), Pt(II) and Ni(II) salts and their catalytic activity has been investigated.

Specifications

Sinónimos

3A8R61G6QV | T-3790 | THIAMORPHOLINE [MI] | EN300-33437 | 1,4-Thiazane | F2158-0924 | CHEBI:36392 | STL193989 | SB12744 | SY033134 | HY-W007359 | Tetrahydro-1,4-thiazine | Thiazolidinane | AKOS005137922 | AS-17826 | 4-thiomorpholine | 1-Thia-4-azacyclohex

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 504754129
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754129
• Sorrisos canónicos: C1CSCCN1
• IUPAC Name: thiomorpholine
• InChIKey: BRNULMACUQOKMR-UHFFFAOYSA-N
• INCHI: 1S/C4H9NS/c1-3-6-4-2-5-1/h5H,1-4H2
• SMILES isoméricas: C1CSCCN1
• WGK Alemanha: 3
• PubChem CID: 67164
• Número UN: 3267
• Peso molecular: 103.19
• Beilstein: 102550
• Reaxy-Rn: 102550

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Thiazinanes
      • Subclass Thiomorpholines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Thiazinanes
• Subclass: Thiomorpholines
• Intermediate Tree Nodes: Not available
• Direct Parent: Thiomorpholines
• Alternative Parents: Dialkylthioethers Dialkylamines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: 1,4-thiazinane - Azacycle - Dialkylthioether - Thioether - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as thiomorpholines. These are heterocyclic compounds containing a thiomorpholine ring, which is a six-membered aliphatic ring containing one nitrogen atom and one sulfur atom at positions 1 and 4 respectively, and four carbon atoms.
• External Descriptors: thiomorpholines - saturated organic heteromonocyclic parent

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

Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Miscible with water and organic solvents.
• Sensibilidade: air sensitive
• Índice de refração: 1.537-1.539
• Ponto de inflamação (°F): 145.4 °F
• Ponto de inflamação (°C): 63 °C
• Ponto de ebulição (°C): 169°C
• Peso molecular: 103.190 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 103.046 Da
• Monoisotopic Mass: 103.046 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 34.500
• 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