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Home> Encyclopedia > Hot Product Listed 5   > 5-Thiazolecarboxylicacid, 2-phenyl-
117086-97-2 structure

5-Thiazolecarboxylicacid, 2-phenyl-

Iupac Name:2-amino-8-hydrazinyl-3,7-dihydropurin-6-one
CAS No.:117086-97-2
Molecular Weight:181.159
Molecular Formula:C46H62N2O5 (isomer)
Properties
Density
1.55
Boiling Point
563.6°C at 760 mmHg
Computational chemical data
  • Molecular Weight:181.159g/mol
  • Molecular Formula:C46H62N2O5
  • Compound Is Canonicalized:True
  • Exact Mass:181.071
  • Monoisotopic Mass:181.071
  • Complexity:264
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:5
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:134A^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: AAADcYBjoAAAAAAAAAAAAAAAAAAAAWAAAAAgAAAAAAAAAEABgAAADgAYAAAACAgBlgABsBbrkACo AQdwdACAgC2HEKIFMQGgVECASAhASCAUAIAYAAJAAGAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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