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(4aR,9bS)-2,8-dimethyl-1,3,4,4a,5,9b-hexahydropyrido[4,3-b]indole;hexadecanoic acid

Base Information
  • Chemical Name:(4aR,9bS)-2,8-dimethyl-1,3,4,4a,5,9b-hexahydropyrido[4,3-b]indole;hexadecanoic acid
  • CAS No.:85202-18-2
  • Molecular Formula:C31H54N2O2
  • Molecular Weight:486.7727
  • Hs Code.:
  • UNII:511UKT4PU1
(4aR,9bS)-2,8-dimethyl-1,3,4,4a,5,9b-hexahydropyrido[4,3-b]indole;hexadecanoic acid

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Chemical Property of (4aR,9bS)-2,8-dimethyl-1,3,4,4a,5,9b-hexahydropyrido[4,3-b]indole;hexadecanoic acid
Chemical Property:
  • Vapor Pressure:3.28E-05mmHg at 25°C 
  • Boiling Point:340.6°Cat760mmHg 
  • Flash Point:154.1°C 
  • Density:g/cm3 
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:6
  • Rotatable Bond Count:28
  • Exact Mass:714.62745910
  • Heavy Atom Count:51
  • Complexity:419
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCC(=O)O.CC1=CC2=C(C=C1)NC3C2CN(CC3)C
  • Isomeric SMILES:CCCCCCCCCCCCCCCC(=O)O.CCCCCCCCCCCCCCCC(=O)O.CC1=CC2=C(C=C1)N[C@H]3[C@@H]2CN(CC3)C
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