2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, compd. with 2-aminoethanol (1:1)

CAS Registry Number®

67939-53-1

CAS Name

2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, compd. with 2-aminoethanol (1:1)

Molecular Formula

C21H36O4.C2H7NO

Molecular Mass

413.59

Cite this Page

2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, compd. with 2-aminoethanol (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=67939-53-1 (retrieved 2025-05-17) (CAS RN: 67939-53-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H36O4.C2H7NO/c1-2-3-4-9-12-18-15-14-17(16-19(18)21(24)25)11-8-6-5-7-10-13-20(22)23;3-1-2-4/h14-15,17-19H,2-13,16H2,1H3,(H,22,23)(H,24,25);4H,1-3H2

InChIKey

InChIKey=WJSMHCRJYTZKHE-UHFFFAOYSA-N

SMILES

C(CCCCC)C1C(C(O)=O)CC(CCCCCCCC(O)=O)C=C1.C(CO)N

Canonical SMILES

O=C(O)CCCCCCCC1C=CC(CCCCCC)C(C(=O)O)C1.OCCN

Other Names for this Substance

  • 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, compd. with 2-aminoethanol (1:1)
  • Ethanol, 2-amino-, 5-carboxy-4-hexyl-2-cyclohexene-1-octanoate (salt)

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