Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed M   > MOLPORT-004-043-141
89816-99-9 structure

MOLPORT-004-043-141

Iupac Name:4-ethyldibenzothiophene
CAS No.:89816-99-9
Molecular Weight:212.31
Molecular Formula:C22H15F2N3O2 (isomer)
Names and Identifiers
Synonyms

2-(4-acetamidophenyl)sulfanyl-n-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide 2-[(4-acetamidophenyl)sulfanyl]-n-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide AB00724914-01 AC1N9GLA MCULE-6132686209 Z25065250

Inchi
InChI=1S/C14H12S/c1-2-10-6-5-8-12-11-7-3-4-9-13(11)15-14(10)12/h3-9H,2H2,1H3
InChkey
BQANWUIWGKINGF-UHFFFAOYSA-N
Canonical Smiles
CCC1=CC=CC2=C1SC3=CC=CC=C23
Properties
Refractive Index
1.704
HS Code
2934999090
Computational chemical data
  • Molecular Weight:212.31g/mol
  • Molecular Formula:C22H15F2N3O2
  • Compound Is Canonicalized:True
  • Exact Mass:212.066
  • Monoisotopic Mass:212.066
  • Complexity:225
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:28.2A^2
  • Heavy Atom Count:15
  • 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: AAADccBwAABAAAAAAAAAAAAAAAAAASAAAAAwYAAAAAAAAEgB/AAAGAQAAAAADACAWAAyAcAAAAiE AiBCAAADAIAgCBBIiBgAAIgIICKgERCAIAAggAAoiAcAgMAOgAACAAAEAAAAAAQAAAgAAAAAAAAA AA==
Recommended Suppliers
  • Tel:1-631-5046093
  • Fax:1-631-6147828
 
<