N,N-Dimethylsulfamoyl fluoride - ≥95% , CAS No.354-44-9

CAS: 354-44-9 Cat. No.: N588847 Molecular Weight: 127.13 EC Number: 844-992-0

GRADE & PURITY ≥95%

Synonyms

N,N-dimethylsulfamoylfluoride | EN300-75797 | N,N-Dimethylsulfamyl fluoride | ES-2161 | N,N-dimethylsulfamoyl fluoride | DTXSID60188878 | Sulfamoyl fluoride, N,N-dimethyl- | C2H6FNO2S | AKOS006283287 | BRN 1751157 | SCHEMBL7913897 | Sulfamyl fluoride, N,N

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

N, N-dimethylsulfamoylfluoride | EN300-75797 | N, N-Dimethylsulfamyl fluoride | ES-2161 | N, N-dimethylsulfamoyl fluoride | DTXSID60188878 | Sulfamoyl fluoride, N, N-dimethyl- | C2H6FNO2S | AKOS006283287 | BRN 1751157 | SCHEMBL7913897 | Sulfamyl fluoride, N, N

Specifications & Purity

≥95%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥95%

Names and Identifiers

• Canonical Smiles: CN(C)S(=O)(=O)F
• IUPAC Name: N,N-dimethylsulfamoyl fluoride
• InChIKey: NNOYMOQFZUUTHQ-UHFFFAOYSA-N
• INCHI: 1S/C2H6FNO2S/c1-4(2)7(3,5)6/h1-2H3
• Isomeric SMILES: CN(C)S(=O)(=O)F
• Molecular Weight: 127.13
• Reaxy-Rn: 1751157
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1751157&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organonitrogen compounds
• Alternative Parents: Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organonitrogen compounds. These are organic compounds containing a nitrogen atom.
• 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

Chemical and Physical Properties

• Molecular Weight: 127.140 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 127.01 Da
• Monoisotopic Mass: 127.01 Da
• Topological Polar Surface Area: 45.800 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 132.000
• 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