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

CAS: 123-90-0 Cat. No.: T111124 Formule: C₄H₉NS Poids moléculaire: 103.19 Beilstein Registry Number: 102550 Numéro 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

Vue d’ensemble

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

Specifications

Synonymes

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

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature,Argon charged

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 504754129
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754129
• Sourires canoniques: C1CSCCN1
• IUPAC Name: thiomorpholine
• InChIKey: BRNULMACUQOKMR-UHFFFAOYSA-N
• INCHI: 1S/C4H9NS/c1-3-6-4-2-5-1/h5H,1-4H2
• Isomères SMILES: C1CSCCN1
• WGK Allemagne: 3
• PubChem CID: 67164
• Numéro ONU: 3267
• Poids moléculaire: 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
• Description: 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

Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Miscible with water and organic solvents.
• Sensibilité: air sensitive
• Indice de réfraction: 1.537-1.539
• Point d'éclair (°F): 145.4 °F
• Point d'éclair (°C): 63 °C
• Point d'ébullition (°C): 169°C
• Poids moléculaire: 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