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Home> Hot Product Listed S   > SBB052911
52301-18-5 structure

SBB052911

Iupac Name:phenyl-tris(prop-1-en-2-yloxy)silane
CAS No.:52301-18-5
Molecular Weight:276.407
Molecular Formula:C20H17N3O4 (isomer)
Names and Identifiers
Synonyms

2-((tetrahydro-2h-pyran-4-yl)oxy)nicotinic acid 2-(2h-3,4,5,6-tetrahydropyran-4-yloxy)pyridine-3-carboxylic acid 2-(oxan-4-yloxy)pyridine-3-carboxylic acid 2-(tetrahydro-2h-pyran-4-yloxy)nicotinic acid AK411701 AKOS010539497 CTK7I9845 KS-00003SLC TS-00540 ZINC40447902

Inchi
InChI=1S/C15H20O3Si/c1-12(2)16-19(17-13(3)4,18-14(5)6)15-10-8-7-9-11-15/h7-11H,1,3,5H2,2,4,6H3
InChkey
XGIZTLFJCDBRDD-UHFFFAOYSA-N
Canonical Smiles
CC(=C)O[Si](C1=CC=CC=C1)(OC(=C)C)OC(=C)C
Properties
Refractive Index
1.495
Safety and Handling
Risk Statements
50/53
Safety Statements
60-61
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
NONS INDIVIDUAL TONNAGE_DATA_CONFIDENTIAL view >
Registered companies:
Registrant / Supplier details Latest dossier received
Shin-Etsu Silicones Europe BV - Importer 2008
more >
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:276.407g/mol
  • Molecular Formula:C20H17N3O4
  • Compound Is Canonicalized:True
  • Exact Mass:276.118
  • Monoisotopic Mass:276.118
  • Complexity:316
  • Rotatable Bond Count:7
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:27.7A^2
  • Heavy Atom Count:19
  • 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: AAADceBwMAgAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGhAAAEAACASAsAAyAIAAAACA ACBCAAACAAAgAAAIiAAAAIgIICKAERCAIAAggAAIiAcAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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