2-Ethoxyethanesulfonyl chloride - ≥96% , CAS No.69371-75-1

CAS: 69371-75-1 Cat. No.: E186070 分子式: C₄H₉ClO₃S 分子量: 172.6 EC番号: 831-994-1

GRADE & PURITY ≥96%

Synonyms

2-Ethoxyethanesulfonyl chloride|69371-75-1|2-ethoxyethane-1-sulfonyl chloride|MFCD10032392|C4H9ClO3S|2-ethoxyethylsulfonyl chloride|2-Ethoxyethanesulfonylchloride|SCHEMBL6279500|DTXSID20626125|AMY41002|RB3342|AKOS009493264|BS-29366|SY023730|FT-0696394|EN3

Storage

Room temperature

Shipped In

Normal

Specifications

同義語

2-Ethoxyethanesulfonyl chloride | 69371-75-1 | 2-ethoxyethane-1-sulfonyl chloride | MFCD10032392 | C4H9ClO3S | 2-ethoxyethylsulfonyl chloride | 2-Ethoxyethanesulfonylchloride | SCHEMBL6279500 | DTXSID20626125 | AMY41002 | RB3342 | AKOS009493264 | BS-29366 | SY023730 | FT-0696394 | EN3

仕様と純度

≥96%

保管条件

Room temperature

入荷

Normal

純度

≥96%

名前と識別子

カノニカル・スマイル

CCOCCS(=O)(=O)Cl

IUPAC Name

2-ethoxyethanesulfonyl chloride

InChIKey

UIZKSVKQIJNZNF-UHFFFAOYSA-N

INCHI

1S/C4H9ClO3S/c1-2-8-3-4-9(5,6)7/h2-4H2,1H3

異性体SMILES

CCOCCS(=O)(=O)Cl

分子量

172.6

Reaxy-Rn

1758574

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1758574&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • 分類 Sulfonyl halides
      • Subclass Sulfonyl chlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• 分類: Sulfonyl halides
• Subclass: Sulfonyl chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Sulfonyl chlorides
• Alternative Parents: Sulfonyls Organosulfonic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Sulfonyl - Sulfonyl chloride - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as sulfonyl chlorides. These are compounds containing a sulfonyl (R-S(=O)2-R') functional group singly bonded to a chlorine 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

化学的性質と物理的性質

• 分子量: 172.630 g/mol
• XLogP3: 0.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 171.996 Da
• Monoisotopic Mass: 171.996 Da
• Topological Polar Surface Area: 51.800 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 146.000
• 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

よくある質問

What is the purity of this product?

This product is supplied at ≥96% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 69371-75-1, the molecular formula is C4H9ClO3S, and the molecular weight is 172.6 g/mol. InChIKey UIZKSVKQIJNZNF-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.