(Heptafluoropropyl)trimethylsilane - ≥97% , CAS No.3834-42-2

CAS: 3834-42-2 Cat. No.: H170054 Molecular Weight: 242.21 Beilstein Registry Number: 1769420 EC Number: 624-436-1

GRADE & PURITY ≥97%

Synonyms

Trimethyl(perfluoropropyl)silane | (Heptafluoropropyl)trimethylsilane, 97% | BS-44162 | DTXSID70400078 | T3593 | 1-(Trimethylsilyl)heptafluoropropane | AKOS015915752 | MFCD00216712 | C6H9F7Si | SCHEMBL104119 | Silane,(1,1,2,2,3,3,3-heptafluoropropyl)trime

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Product Application：

Used to prepare perfluoroalkyl compounds and heptafluoro-n-propyl derivatives of phosphorus and silicon. Reactant involved in: Trifluoromethylation of arenes ,Nucleophilic addition followed by intramolecular aza-Michael reactions ,Perfluoroalkylation of carbonyl compounds, aldimines and other organic substrates

Specifications

Synonyms

Trimethyl(perfluoropropyl)silane | (Heptafluoropropyl)trimethylsilane, 97% | BS-44162 | DTXSID70400078 | T3593 | 1-(Trimethylsilyl)heptafluoropropane | AKOS015915752 | MFCD00216712 | C6H9F7Si | SCHEMBL104119 | Silane, (1, 1, 2, 2, 3, 3, 3-heptafluoropropyl)trime

Specifications & Purity

≥97%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

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

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C[Si](C)(C)C(C(C(F)(F)F)(F)F)(F)F
• IUPAC Name: 1,1,2,2,3,3,3-heptafluoropropyl(trimethyl)silane
• InChIKey: PKLASFRWKXWKII-UHFFFAOYSA-N
• INCHI: 1S/C6H9F7Si/c1-14(2,3)6(12,13)4(7,8)5(9,10)11/h1-3H3
• Isomeric SMILES: C[Si](C)(C)C(C(C(F)(F)F)(F)F)(F)F
• WGK Germany: 3
• Molecular Weight: 242.21
• Beilstein: 1769420
• Reaxy-Rn: 1769415
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1769415&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • Class Organic metal salts
      • Subclass Organic metalloid salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• Class: Organic metal salts
• Subclass: Organic metalloid salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic metalloid salts
• Alternative Parents: Organofluorides Hydrocarbon derivatives Alkylsilanes Alkyl fluorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic metalloid salt - Hydrocarbon derivative - Organosilicon compound - Alkylsilane - Organofluoride - Organic metalloid moeity - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organic metalloid salts. These are organic salt compounds containing a metalloid atom in its ionic form.
• 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: n20/D 1.324
• Flash Point(°F): 129.2 °F
• Flash Point(°C): 54 °C
• Boil Point(°C): 88 °C
• Molecular Weight: 242.210 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 242.036 Da
• Monoisotopic Mass: 242.036 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 211.000
• 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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