1λ⁶,4-thiazepane-1,1-dione - ≥97% , CAS No.756815-81-3

CAS: 756815-81-3 Cat. No.: T634493 Peso molecular: 149.21 PubChem CID: 73977772

GRADE & PURITY ≥97%

Synonyms

756815-81-3 | 1,4-THIAZEPANE-1,1-DIOXIDE TRIFLUORO ACETATE | 1,4-Thiazepane-1,1-dioxidetrifluoroacetate | 1,4-thiazepane 1,1-dioxide | 2,2,2-trifluoroacetic acid | 1,4-THIAZEPANE-1,1-DIOXIDE TRIFLUOROACETATE

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

756815-81-3 | 1, 4-THIAZEPANE-1, 1-DIOXIDE TRIFLUORO ACETATE | 1, 4-Thiazepane-1, 1-dioxidetrifluoroacetate | 1, 4-thiazepane 1, 1-dioxide | 2, 2, 2-trifluoroacetic acid | 1, 4-THIAZEPANE-1, 1-DIOXIDE TRIFLUOROACETATE

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: C1CNCCS(=O)(=O)C1.C(=O)(C(F)(F)F)O
• IUPAC Name: 1,4-thiazepane 1,1-dioxide;2,2,2-trifluoroacetic acid
• InChIKey: KCMGFQFURXPBDZ-UHFFFAOYSA-N
• INCHI: 1S/C5H11NO2S.C2HF3O2/c7-9(8)4-1-2-6-3-5-9;3-2(4,5)1(6)7/h6H,1-5H2;(H,6,7)
• Isómeros SMILES: C1CNCCS(=O)(=O)C1.C(=O)(C(F)(F)F)O
• PubChem CID: 73977772
• Peso molecular: 149.21

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organosulfur compounds
    • Clase Sulfonyls
      • Subclass Sulfones

• Kingdom: Organic compounds
• Superclass: Organosulfur compounds
• Clase: Sulfonyls
• Subclass: Sulfones
• Intermediate Tree Nodes: Not available
• Direct Parent: Sulfones
• Alternative Parents: Alpha-halocarboxylic acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
• Molecular Framework: Not available
• Substituents: Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Sulfone - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Alkyl fluoride - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Amine - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as sulfones. These are compounds containing a sulfonyl group( which as the general structure RS(=O)2R' (R,R' =alkyl, aryl)) attached to two carbon atoms.
• 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