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Home> Hot Product Listed F   > F5149-0660
13055-06-6 structure

F5149-0660

CAS No.:13055-06-6
Molecular Weight:259.17296
Molecular Formula:C7H4CLNO (isomer)
Names and Identifiers
Synonyms

1-(3-(3-(4-fluorophenyl)-6-oxopyridazin-1(6h)-yl)propyl)-3-(thiophen-2-yl)urea AKOS024500516 MCULE-1321066744 MOLPORT-009-726-845 VU0637416-1 ZINC13802269

Inchi
InChI=1/C8H9N3O7/c12-3(13)1-11(2-4(14)15)5-6(16)9-8(18)10-7(5)17/h5H,1-2H2,(H,12,13)(H,14,15)(H2,9,10,16,17,18)
Canonical Smiles
C(C(=O)O)N(CC(=O)O)C1C(=O)NC(=O)NC1=O
Properties
Refractive Index
1.631
HS Code
2933990090
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:259.17296g/mol
  • Molecular Formula:C7H4CLNO
  • Exact Mass:259.04405
  • Monoisotopic Mass:259.04405
  • Complexity:396
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:4
  • Hydrogen Bond Acceptor Count:8
  • Topological Polar Surface Area:153
  • 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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