Chlorotriethylsilane - ≥98% , CAS No.994-30-9

CAS: 994-30-9 Cat. No.: C107619 Molecular Weight: 150.72 Beilstein Registry Number: 1732860 EC Number: 213-615-6

GRADE & PURITY ≥98%

Synonyms

TESCl | BP-20176 | H10691 | Chlorotrietylsilane | CHLOROTRIETHYLSILANE | chloro-triethyl-silane | chlorotriethyl-silane | Triethylsilyl Chloride | chlorotriethyl silane | Chlorotriethylsilane, produced by Wacker Chemie AG, Burghausen, Germany, >=99.0% | E

Storage

Argon charged,Room temperature

Shipped In

Normal

Overview

Employed together with Grignard reagents in a palladium-catalyzed carbosilylation of allenes. The Grignard attacks the allene central carbon and the terminal carbon is silylated

Specifications

Synonyms

TESCl | BP-20176 | H10691 | Chlorotrietylsilane | CHLOROTRIETHYLSILANE | chloro-triethyl-silane | chlorotriethyl-silane | Triethylsilyl Chloride | chlorotriethyl silane | Chlorotriethylsilane, produced by Wacker Chemie AG, Burghausen, Germany, >=99.0% | E

Specifications & Purity

≥98%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 504752493
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752493
• Canonical Smiles: CC[Si](CC)(CC)Cl
• IUPAC Name: chloro(triethyl)silane
• InChIKey: DCFKHNIGBAHNSS-UHFFFAOYSA-N
• INCHI: 1S/C6H15ClSi/c1-4-8(7,5-2)6-3/h4-6H2,1-3H3
• Isomeric SMILES: CC[Si](CC)(CC)Cl
• WGK Germany: 1
• UN Number: 2986
• Packing Group: II
• Molecular Weight: 150.72
• Beilstein: 1732860
• Reaxy-Rn: 1732860
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1732860&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organometalloid compounds
      • Subclass Organosilicon compounds
        • Level5 Organoheterosilanes
          • Level6 Trialkylheterosilanes
            • Level7 Trialkylchlorosilanes

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Organoheterosilanes - Trialkylheterosilanes
• Direct Parent: Trialkylchlorosilanes
• Alternative Parents: Silyl monohalides Organochlorosilanes Organic metalloid salts Alkylhalosilanes Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkylchlorosilane - Silyl monohalide - Organochlorosilane - Organic metalloid salt - Alkylhalosilane - Hydrocarbon derivative - Organic salt - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as trialkylchlorosilanes. These are organoheterosilanes, bearing a silicon atom linked to three alkyl groups and one 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

Chemical and Physical Properties

• Solubility: Soluble in aprotic organic solvents.
• Sensitivity: Moisture Sensitive
• Refractive Index: n20/D 1.43 (lit.)
• Flash Point(°F): 86.0 °F
• Flash Point(°C): 30°C
• Boil Point(°C): 142-144 °C
• Molecular Weight: 150.720 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 150.063 Da
• Monoisotopic Mass: 150.063 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 51.300
• 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

XLogP3

References

1. Jinfeng Shi, Zhengyang Liu, Na Zhao, Shaofeng Liu, Zhibo Li.  (2022)  Controlled Ring-Opening Polymerization of Hexamethylcyclotrisiloxane Catalyzed by Trisphosphazene Organobase to Well-Defined Poly(dimethylsiloxane)s.  MACROMOLECULES,      [PMID:] [10.1021/acs.macromol.1c02654]