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Home> Hot Product Listed M   > MOLPORT-020-127-207
58359-53-8 structure

MOLPORT-020-127-207

Iupac Name:4-phenyldiazenylbenzenesulfonyl chloride
CAS No.:58359-53-8
Molecular Weight:280.73006
Molecular Formula:C18H17FN2OS (isomer)
Names and Identifiers
Synonyms

1-(2-ethyl-1,3-thiazole-5-carbonyl)-4-{5h,6h,7h-pyrrolo[2,1-c][1,2,4]triazol-3-yl}piperidine MCULE-8923058118 Z855104656 ZINC71831001

Inchi
InChI=1/C12H9ClN2O2S/c13-18(16,17)12-8-6-11(7-9-12)15-14-10-4-2-1-3-5-10/h1-9H/b15-14+
Canonical Smiles
C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)Cl
Properties
Melting Point
122 °C
Refractive Index
1.622
HS Code
2927000090
Computational chemical data
  • Molecular Weight:280.73006g/mol
  • Molecular Formula:C18H17FN2OS
  • XLogP3-AA:4.1
  • Exact Mass:280.007326
  • Monoisotopic Mass:280.007326
  • Complexity:377
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:67.2
  • Heavy Atom Count:18
  • 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
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Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:1-631-5046093
  • Fax:1-631-6147828
 
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