Cas no 708-18-9 (1H-Cyclopenta[c]pyridine-4-methanol,octahydro-2,7-dimethyl-, (4R,4aR,7R,7aS)-)

1H-Cyclopenta[c]pyridine-4-methanol,octahydro-2,7-dimethyl-, (4R,4aR,7R,7aS)- structure
708-18-9 structure
Product Name:1H-Cyclopenta[c]pyridine-4-methanol,octahydro-2,7-dimethyl-, (4R,4aR,7R,7aS)-
CAS No:708-18-9
MF:C11H21NO
MW:183.290543317795
CID:567037
PubChem ID:10261788
Update Time:2025-04-19

1H-Cyclopenta[c]pyridine-4-methanol,octahydro-2,7-dimethyl-, (4R,4aR,7R,7aS)- Chemical and Physical Properties

Names and Identifiers

    • 1H-Cyclopenta[c]pyridine-4-methanol,octahydro-2,7-dimethyl-, (4R,4aR,7R,7aS)-
    • (2,7-dimethyl-1,3,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridin-4-yl)methanol
    • TECOSTANINE
    • Tecostanin
    • 5-21-01-00349 (Beilstein Handbook Reference)
    • DTXSID10991071
    • AC1L3RGJ
    • LS-148644
    • BRN 1422487
    • Octahydro-2,7-dimethyl-1H-2-pyrindine-4-methanol
    • Q27108388
    • C09989
    • CHEBI:9425
    • (2,7-dimethyloctahydro-1H-cyclopenta[c]pyridin-4-yl)methanol
    • 1H-2-Pyrindine-4-methanol, octahydro-2,7-dimethyl-
    • 708-18-9
    • SCHEMBL22926628
    • Inchi: 1S/C11H21NO/c1-8-3-4-10-9(7-13)5-12(2)6-11(8)10/h8-11,13H,3-7H2,1-2H3
    • InChI Key: CRVXJVHSLVEDRI-UHFFFAOYSA-N
    • SMILES: OCC1CN(C)CC2C(C)CCC21

Computed Properties

  • Exact Mass: 183.16243
  • Monoisotopic Mass: 183.162314293g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 183
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 4
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 23.5?2

Experimental Properties

  • Density: 0.963
  • Boiling Point: 245.3°C at 760 mmHg
  • Flash Point: 89.4°C
  • Refractive Index: 1.48
  • PSA: 23.47
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