N,O-Bis(tert-butyldimethylsilyl)acetamide [tert-Butyldimethylsilylating Agent] - ≥95%(GC) , CAS No.82112-21-8

CAS: 82112-21-8 Cat. No.: N159857 Molecular Weight: 287.59 EC Number: 678-040-9

GRADE & PURITY ≥95%(GC)

Synonyms

Acetamide, O,N-bis-DMTBS | N,O-Bis(tert-butyldimethylsilyl)acetamide [tert-Butyldimethylsilylating Agent] | (E)-(TERT-BUTYLDIMETHYLSILYL N-(TERT-BUTYLDIMETHYLSILYL)ETHANIMIDATE) | XFPQBAQQJIQJLY-UHFFFAOYSA-N | (E)-tert-butyldimethylsilyl N-tert-butyldimet

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Acetamide, O, N-bis-DMTBS | N, O-Bis(tert-butyldimethylsilyl)acetamide [tert-Butyldimethylsilylating Agent] | (E)-(TERT-BUTYLDIMETHYLSILYL N-(TERT-BUTYLDIMETHYLSILYL)ETHANIMIDATE) | XFPQBAQQJIQJLY-UHFFFAOYSA-N | (E)-tert-butyldimethylsilyl N-tert-butyldimet

Specifications & Purity

≥95%(GC)

Storage

Room temperature

Shipped In

Normal

Purity

≥95%(GC)

Names and Identifiers

• Canonical Smiles: CC(=N[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
• IUPAC Name: [tert-butyl(dimethyl)silyl] N-[tert-butyl(dimethyl)silyl]ethanimidate
• InChIKey: XFPQBAQQJIQJLY-UHFFFAOYSA-N
• INCHI: 1S/C14H33NOSi2/c1-12(15-17(8,9)13(2,3)4)16-18(10,11)14(5,6)7/h1-11H3
• Isomeric SMILES: CC(=N[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C
• Molecular Weight: 287.59
• Reaxy-Rn: 2096003
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2096003&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organometallic compounds
• Class: Organometalloid compounds
• Subclass: Organosilicon compounds
• Intermediate Tree Nodes: Organoheterosilanes
• Direct Parent: Trialkylheterosilanes
• Alternative Parents: Organic metalloid salts N-silyl compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkylheterosilane - N-silyl compound - Organic metalloid salt - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organonitrogen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as trialkylheterosilanes. These are organoheterosilanes, bearing a silicon atom linked to three alkyl groups and one heteroatom.
• 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

• Sensitivity: Moisture Sensitive
• Flash Point(°C): 125 °C
• Molecular Weight: 287.590 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 287.21 Da
• Monoisotopic Mass: 287.21 Da
• Topological Polar Surface Area: 21.600 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 320.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 1
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1

XLogP3