tert-Butyl[4-(dimethoxymethyl)phenoxy]dimethylsilane - ≥98% , CAS No.118736-04-2

CAS: 118736-04-2 Cat. No.: T161835 Molecular Weight: 282.46 PubChem CID: 11391917

GRADE & PURITY ≥98%

Synonyms

4-(tert-Butyldimethylsilyloxy)benzaldehyde Dimethyl Acetal | MFCD18207715 | T70130 | tert-butyl-[4-(dimethoxymethyl)phenoxy]-dimethylsilane | tert-Butyl[4-(dimethoxymethyl)phenoxy]dimethylsilane | AKOS015837831 | 1-(tert-Butyldimethylsilyloxy)-4-(dimethox

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

4-(tert-Butyldimethylsilyloxy)benzaldehyde Dimethyl Acetal | MFCD18207715 | T70130 | tert-butyl-[4-(dimethoxymethyl)phenoxy]-dimethylsilane | tert-Butyl[4-(dimethoxymethyl)phenoxy]dimethylsilane | AKOS015837831 | 1-(tert-Butyldimethylsilyloxy)-4-(dimethox

Specifications & Purity

≥98%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Canonical Smiles: CC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)C(OC)OC
• IUPAC Name: tert-butyl-[4-(dimethoxymethyl)phenoxy]-dimethylsilane
• InChIKey: DGWQQAQYHUNLGD-UHFFFAOYSA-N
• INCHI: 1S/C15H26O3Si/c1-15(2,3)19(6,7)18-13-10-8-12(9-11-13)14(16-4)17-5/h8-11,14H,1-7H3
• Isomeric SMILES: CC(C)(C)[Si](C)(C)OC1=CC=C(C=C1)C(OC)OC
• PubChem CID: 11391917
• Molecular Weight: 282.46
• Reaxy-Rn: 8685945

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Benzylethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Benzylethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzylethers
• Alternative Parents: Phenoxy compounds Trialkylheterosilanes Organic metalloid salts Acetals Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzylether - Phenoxy compound - Trialkylheterosilane - Organoheterosilane - Organic metalloid salt - Acetal - Organic oxygen compound - Hydrocarbon derivative - Organosilicon compound - Organooxygen compound - Organic metalloid moeity - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene).
• 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
• Refractive Index: 1.48
• Molecular Weight: 282.450 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 282.165 Da
• Monoisotopic Mass: 282.165 Da
• Topological Polar Surface Area: 27.700 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 261.000
• 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

XLogP3