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Home> Hot Product Listed T   > T6901412
2117-24-0 structure

T6901412

Iupac Name:trimethyl-(4-trimethylsilyloxyphenoxy)silane
CAS No.:2117-24-0
Molecular Weight:254.476
Molecular Formula:C22H24N2O2S2 (isomer)
Names and Identifiers
Synonyms

MCULE-3339333563 MOLPORT-009-407-948 n-(6-chloro-3,4-dihydro-2h-1-benzothiopyran-4-yl)-3-(methylsulfanyl)propanamide Z164999416

Inchi
InChI=1S/C12H22O2Si2/c1-15(2,3)13-11-7-9-12(10-8-11)14-16(4,5)6/h7-10H,1-6H3
InChkey
DVLYYIZODAWMML-UHFFFAOYSA-N
Canonical Smiles
C[Si](C)(C)OC1=CC=C(C=C1)O[Si](C)(C)C
Properties
Vapour
2.05E-06mmHg at 25°C
Refractive Index
1.608
HS Code
2931900090
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:254.476g/mol
  • Molecular Formula:C22H24N2O2S2
  • Compound Is Canonicalized:True
  • Exact Mass:254.116
  • Monoisotopic Mass:254.116
  • Complexity:186
  • Rotatable Bond Count:4
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:18.5A^2
  • Heavy Atom Count:16
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceBwMAwAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGhAAAEAACASAkAByBoAAAAGA ACBCAAACAAAgIAAIiAAGCIgIJiKAERKAMAAkwBEIiAfAQAAAAQAAAAAAAAACAAAAAAAAAAAAAAAA AA==
 
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