Cas no 155800-91-2 ((6R*,8S*)-6,8-Tetratriacontanediol)

(6R*,8S*)-6,8-Tetratriacontanediol structure
155800-91-2 structure
Product Name:(6R*,8S*)-6,8-Tetratriacontanediol
CAS No:155800-91-2
MF:C34H70O2
MW:510.91841173172
CID:2005540
PubChem ID:10459029
Update Time:2025-04-21

(6R*,8S*)-6,8-Tetratriacontanediol Chemical and Physical Properties

Names and Identifiers

    • (6R*,8S*)-6,8-Tetratriacontanediol
    • tetratriacontane-6,8-diol
    • rel-(6R,8S)-6,8-Tetratriacontanediol
    • 155800-91-2
    • DTXSID801289392
    • Inchi: 1S/C34H70O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-29-31-34(36)32-33(35)30-28-6-4-2/h33-36H,3-32H2,1-2H3/t33-,34+/m1/s1
    • InChI Key: QRVPXJSEKKWYDP-NOCHOARKSA-N
    • SMILES: O[C@H](C[C@@H](CCCCC)O)CCCCCCCCCCCCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 510.53758147g/mol
  • Monoisotopic Mass: 510.53758147g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 36
  • Rotatable Bond Count: 31
  • Complexity: 383
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 2
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 15.4
  • Topological Polar Surface Area: 40.5?2
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