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Home> Hot Product Listed C   > C.I. Basic Black 8(8CI,9CI)
848324-33-4 structure

C.I. Basic Black 8(8CI,9CI)

Iupac Name:2-amino-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxamide
CAS No.:848324-33-4
Molecular Weight:198.24
Molecular Formula:C19H24CL6O13 (isomer)
Names and Identifiers
Synonyms

Diacryl Supra Black BSL DiacrylBlack BSL-F

Inchi
InChI=1S/C8H10N2O2S/c9-7(11)6-4-1-2-12-3-5(4)13-8(6)10/h1-3,10H2,(H2,9,11)
InChkey
NXXFLPNSJIRRSJ-UHFFFAOYSA-N
Canonical Smiles
C1COCC2=C1C(=C(S2)N)C(=O)N
Properties
Density
1.109
Computational chemical data
  • Molecular Weight:198.24g/mol
  • Molecular Formula:C19H24CL6O13
  • Compound Is Canonicalized:True
  • Exact Mass:198.046
  • Monoisotopic Mass:198.046
  • Complexity:224
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:107A^2
  • Heavy Atom Count:13
  • 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: AAADccBzMABAAAAAAAAAAAAAAAAAASAAAAAkAAAAAAAAAEgBgAAAHgQQAAAADACh2AIAgYBABAiM AgFQUACDAIBkCBEAiBEATMgIJjqg9JmCEYBkwAEo6UaYFAAOgAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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