Cinchonan-9-ol, 10,11-dihydro-6′-[(6-methylheptyl)oxy]-, (8α,9R)-

CAS Registry Number®

130-87-0

CAS Name

Cinchonan-9-ol, 10,11-dihydro-6′-[(6-methylheptyl)oxy]-, (8α,9R)-

Molecular Formula

C27H40N2O2

Molecular Mass

424.62

Cite this Page

Cinchonan-9-ol, 10,11-dihydro-6′-[(6-methylheptyl)oxy]-, (8α,9R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=130-87-0 (retrieved 2024-11-22) (CAS RN: 130-87-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H40N2O2/c1-4-20-18-29-14-12-21(20)16-26(29)27(30)23-11-13-28-25-10-9-22(17-24(23)25)31-15-7-5-6-8-19(2)3/h9-11,13,17,19-21,26-27,30H,4-8,12,14-16,18H2,1-3H3/t20-,21-,26-,27+/m0/s1

InChIKey

InChIKey=DIOGDSVVUWNLHM-LKSLQULUSA-N

SMILES

[C@@H](O)(C=1C2=C(C=CC(OCCCCCC(C)C)=C2)N=CC1)[C@]3([N@@]4C[C@H](CC)[C@](C3)(CC4)[H])[H]

Canonical SMILES

OC(C=1C=CN=C2C=CC(OCCCCCC(C)C)=CC21)C3N4CCC(C3)C(C4)CC

Other Names for this Substance

  • Cinchonan-9-ol, 10,11-dihydro-6′-[(6-methylheptyl)oxy]-, (8α,9R)-
  • Hydrocupreine, O6′-isooctyl-
  • Hydrocupreine, 6-methylheptyl ether
  • Isooctylhydrocuprein
  • Isooctylhydrocupreine

View All

Deleted or Replaced CAS Registry Numbers

11000-09-2, 854812-51-4, 856567-96-9, 872278-57-4