1-(Dimethylisopropylsilyl)imidazole [Dimethylisopropylsilylating Agent] - ≥98%(T) , CAS No.81452-04-2

CAS: 81452-04-2 Cat. No.: D155941 Molecular Weight: 168.32 EC Number: 679-753-8

GRADE & PURITY ≥98%(T)

Synonyms

1-(Dimethylisopropylsilyl)imidazole | DIMETHYLISOPROPYLSILYLIMIDAZOLE | SCHEMBL918948 | 1-(Isopropyldimethylsilyl)imidazole | imidazol-1-yl-dimethyl-propan-2-ylsilane | FT-0641828 | 1-(Isopropyldimethylsilyl)-1H-imidazole | MFCD00059891 | DMIPS | AKOS0253

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyms

1-(Dimethylisopropylsilyl)imidazole | DIMETHYLISOPROPYLSILYLIMIDAZOLE | SCHEMBL918948 | 1-(Isopropyldimethylsilyl)imidazole | imidazol-1-yl-dimethyl-propan-2-ylsilane | FT-0641828 | 1-(Isopropyldimethylsilyl)-1H-imidazole | MFCD00059891 | DMIPS | AKOS0253

Specifications & Purity

≥98%(T)

Storage

Store at 2-8°C

Shipped In

Wet ice

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

Purity

≥98%(T)

Names and Identifiers

• Canonical Smiles: CC(C)[Si](C)(C)N1C=CN=C1
• IUPAC Name: imidazol-1-yl-dimethyl-propan-2-ylsilane
• InChIKey: OCUUDCWEKWOMFA-UHFFFAOYSA-N
• INCHI: 1S/C8H16N2Si/c1-8(2)11(3,4)10-6-5-9-7-10/h5-8H,1-4H3
• Isomeric SMILES: CC(C)[Si](C)(C)N1C=CN=C1
• Molecular Weight: 168.32
• Reaxy-Rn: 5500147
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5500147&ln=

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: N-substituted imidazoles Trialkylheterosilanes Heteroaromatic compounds Organic metalloid salts N-silyl compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkylarylsilane - N-substituted imidazole - Trialkylheterosilane - Heteroaromatic compound - Imidazole - Azole - N-silyl compound - Organoheterosilane - Azacycle - Organic metalloid salt - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen 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

• Sensitivity: Moisture Sensitive,Heat Sensitive
• Molecular Weight: 168.310 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 168.108 Da
• Monoisotopic Mass: 168.108 Da
• Topological Polar Surface Area: 17.800 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 134.000
• 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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