2-Furyltrimethylsilane , CAS No.1578-33-2

CAS: 1578-33-2 Cat. No.: F1056791 EC Number: 977-275-7 PubChem CID: 137092

Storage

Room temperature

Specifications

Storage

Room temperature

Names and Identifiers

• Canonical Smiles: C[Si](C)(C)C1=CC=CO1
• IUPAC Name: furan-2-yl(trimethyl)silane
• InChIKey: HRWRZEKRKZRDRW-UHFFFAOYSA-N
• INCHI: 1S/C7H12OSi/c1-9(2,3)7-5-4-6-8-7/h4-6H,1-3H3
• Isomeric SMILES: C[Si](C)(C)C1=CC=CO1
• Alternate CAS: 1578-33-2
• PubChem CID: 137092

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organometallic compounds
    • Class Organometalloid compounds
      • Subclass Organosilicon compounds

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkylarylsilanes
• Alternative Parents: Heteroaromatic compounds Furans Oxacyclic compounds Organic metalloid salts Organooxygen compounds Hydrocarbon derivatives Alkylsilanes
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkylarylsilane - Heteroaromatic compound - Furan - Oxacycle - Organic metalloid salt - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organic salt - Alkylsilane - Organooxygen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as alkylarylsilanes. These are organosilicon compounds with the general formula R[Si]R' (R = alkyl, R' = aryl).
• 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

• Molecular Weight: 140.250 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 140.066 Da
• Monoisotopic Mass: 140.066 Da
• Topological Polar Surface Area: 13.100 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 95.600
• 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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