2-(Trimethylsilyl)ethoxymethyl chloride - technical grade , CAS No.76513-69-4

CAS: 76513-69-4 Cat. No.: T476911 Molecular Weight: 166.72 Beilstein Registry Number: 3587289 EC Number: 278-483-4 PubChem CID: 2724271

GRADE & PURITY Technical grade

Synonyms

{2-[(chloromethyl)oxy]ethyl)(trimethyl)silane | 2-trimethylsilylethyoxymethyl chloride | AKOS005259763 | {2-(chloromethoxy)ethyl}trimethylsilane | (2-(CHLOROMETHOXY)ETHYL)TRIMETHYLSILANE | (2-(chloromethoxy)ethyl)-trimethylsilane | (2-(chloromethoxy)ethyl

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

Description

Learn More at theProfessor and Product Portalof Professor Bruce Lipshutz.Phenol protecting group in the synthesis of laterifluorones.Used to prepare a SEM-ether which was, in turn, removed with BBr3and cyclized to a benzo-oxapane.

Specifications

Synonyms

{2-[(chloromethyl)oxy]ethyl)(trimethyl)silane | 2-trimethylsilylethyoxymethyl chloride | AKOS005259763 | {2-(chloromethoxy)ethyl}trimethylsilane | (2-(CHLOROMETHOXY)ETHYL)TRIMETHYLSILANE | (2-(chloromethoxy)ethyl)-trimethylsilane | (2-(chloromethoxy)ethyl

Specifications & Purity

technical grade

Storage

Store at 2-8°C

Shipped In

Wet ice

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

Grade

Technical grade

Names and Identifiers

• Canonical Smiles: C[Si](C)(C)CCOCCl
• IUPAC Name: 2-(chloromethoxy)ethyl-trimethylsilane
• InChIKey: BPXKZEMBEZGUAH-UHFFFAOYSA-N
• INCHI: 1S/C6H15ClOSi/c1-9(2,3)5-4-8-6-7/h4-6H2,1-3H3
• Isomeric SMILES: C[Si](C)(C)CCOCCl
• WGK Germany: 3
• PubChem CID: 2724271
• UN Number: 2920
• Packing Group: II
• Molecular Weight: 166.72
• Beilstein: 3587289
• Reaxy-Rn: 3587289

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Organic metalloid salts Organochlorides Hydrocarbon derivatives Alkylsilanes Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic metalloid salt - Dialkyl ether - Hydrocarbon derivative - Organic salt - Organosilicon compound - Alkylsilane - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• 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

• Refractive Index: 1.435-1.437
• Flash Point(°F): 114.8 °F
• Flash Point(°C): 46 °C
• Boil Point(°C): 57-59 °C/8 mmHg
• Molecular Weight: 166.720 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 166.058 Da
• Monoisotopic Mass: 166.058 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 69.900
• 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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