Phenyl Trimethylsilylmethyl Sulfone - ≥95% , CAS No.17872-92-3

CAS: 17872-92-3 Cat. No.: P160551 Molecular Weight: 228.38 Beilstein Registry Number: 6(4)1508 EC Number: 679-678-0 PubChem CID: 3290840

GRADE & PURITY ≥95%

Synonyms

Phenyl Trimethylsilylmethyl Sulfone | FT-0637617 | DTXSID10391113 | MFCD00012364 | T71947 | (phenylsulfonyl)trimethylsilylmethane | SCHEMBL3295258 | AKOS015840058 | [(benzenesulfonyl)methyl]trimethylsilane | Benzene, [[(trimethylsilyl)methyl]sulfonyl]- |

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

Phenyl Trimethylsilylmethyl Sulfone | FT-0637617 | DTXSID10391113 | MFCD00012364 | T71947 | (phenylsulfonyl)trimethylsilylmethane | SCHEMBL3295258 | AKOS015840058 | [(benzenesulfonyl)methyl]trimethylsilane | Benzene, [[(trimethylsilyl)methyl]sulfonyl]- |

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

• Pubchem Sid: 504762528
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504762528
• Canonical Smiles: C[Si](C)(C)CS(=O)(=O)C1=CC=CC=C1
• IUPAC Name: benzenesulfonylmethyl(trimethyl)silane
• InChIKey: OEXJFEDAGJGOEP-UHFFFAOYSA-N
• INCHI: 1S/C10H16O2SSi/c1-14(2,3)9-13(11,12)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
• Isomeric SMILES: C[Si](C)(C)CS(=O)(=O)C1=CC=CC=C1
• PubChem CID: 3290840
• Molecular Weight: 228.38
• Beilstein: 6(4)1508
• Reaxy-Rn: 1960911

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Benzenesulfonyl compounds

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Benzenesulfonyl compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzenesulfonyl compounds
• Alternative Parents: Sulfones Organic metalloid salts Organic oxides Hydrocarbon derivatives Alkylsilanes
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzenesulfonyl group - Sulfonyl - Sulfone - Organic metalloid salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosilicon compound - Alkylsilane - Organosulfur compound - Organic metalloid moeity - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.
• 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

• Sensitivity: Moisture Sensitive
• Melt Point(°C): 25 °C
• Molecular Weight: 228.380 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 228.064 Da
• Monoisotopic Mass: 228.064 Da
• Topological Polar Surface Area: 42.500 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 265.000
• 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

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