2-Mesitylenesulfonyl Hydrazide - ≥97% , CAS No.16182-15-3

CAS: 16182-15-3 Cat. No.: M158770 Peso molecular: 214.28 Beilstein Registry Number: 2118380 Número EC: 240-319-4

GRADE & PURITY ≥97%

Synonyms

SY017927 | C93429 | BBL014043 | FT-0612780 | Mesitylene-2-sulphonohydrazide | mesitylenesulphonohydrazide | 2,4,6-Trimethylbenzenesulfonic acid hydrazide | Mesitylenesulfonylhydrazide | 8abp | JQUBKTQDNVZHIY-UHFFFAOYSA-N | 2,4,6-Trimethylbenzenesulfonohyd

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

SY017927 | C93429 | BBL014043 | FT-0612780 | Mesitylene-2-sulphonohydrazide | mesitylenesulphonohydrazide | 2, 4, 6-Trimethylbenzenesulfonic acid hydrazide | Mesitylenesulfonylhydrazide | 8abp | JQUBKTQDNVZHIY-UHFFFAOYSA-N | 2, 4, 6-Trimethylbenzenesulfonohyd

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: CC1=CC(=C(C(=C1)C)S(=O)(=O)NN)C
• IUPAC Name: 2,4,6-trimethylbenzenesulfonohydrazide
• InChIKey: JQUBKTQDNVZHIY-UHFFFAOYSA-N
• INCHI: 1S/C9H14N2O2S/c1-6-4-7(2)9(8(3)5-6)14(12,13)11-10/h4-5,11H,10H2,1-3H3
• Isómeros SMILES: CC1=CC(=C(C(=C1)C)S(=O)(=O)NN)C
• WGK Alemania: 3
• Peso molecular: 214.28
• Beilstein: 2118380
• Reaxy-Rn: 2118380
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2118380&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Benzenesulfonamides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Benzenesulfonamides
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzenesulfonamides
• Alternative Parents: Benzenesulfonyl compounds Sulfonohydrazides Hydrazinosulfonyl compounds Organic oxides Organic nitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzenesulfonamide - Benzenesulfonyl group - Hydrazinosulfonyl compound - Sulfonohydrazide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring.
• 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

Propiedades químicas y físicas

• Sensibilidad: air sensitive
• Punto de fusión (°C): 114 °C(dec.)
• Peso molecular: 214.290 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 214.078 Da
• Monoisotopic Mass: 214.078 Da
• Topological Polar Surface Area: 80.600 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 272.000
• 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