Hexanoic acid, 2-ethyl-, compd. with 2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine (1:1)

CAS Registry Number®

33918-18-2

CAS Name

Hexanoic acid, 2-ethyl-, compd. with 2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine (1:1)

Molecular Formula

C9H16N2.C8H16O2

Cite this Page

Hexanoic acid, 2-ethyl-, compd. with 2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=33918-18-2 (retrieved 2024-11-22) (CAS RN: 33918-18-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H16N2.C8H16O2/c1-2-5-9-10-6-4-8-11(9)7-3-1;1-3-5-6-7(4-2)8(9)10/h1-8H2;7H,3-6H2,1-2H3,(H,9,10)

InChIKey

InChIKey=CZGBZUGXSWLVRA-UHFFFAOYSA-N

SMILES

C=12N(CCCN1)CCCCC2.C(CCCC)(C(O)=O)CC

Canonical SMILES

O=C(O)C(CC)CCCC.N1=C2N(CCC1)CCCCC2

Other Names for this Substance

  • Hexanoic acid, 2-ethyl-, compd. with 2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepine (1:1)
  • Pyrimido[1,2-a]azepine, 2,3,4,6,7,8,9,10-octahydro-, mono(2-ethylhexanoate)
  • 1,8-Diazabicyclo[5.4.0]undec-7-ene 2-ethylhexanoic acid salt
  • 1,8-Diazabicyclo[5.4.0]undec-7-ene 2-ethylhexanoate
  • 1,8-Diazabicyclo[5.4.0]-7-undecene 2-ethylhexoate

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Deleted or Replaced CAS Registry Numbers

97143-76-5, 100568-27-2, 113403-06-8, 114167-00-9, 60317-36-4, 77193-58-9, 80004-12-2, 83329-52-6, 168967-85-9

CAS INSIGHTSTM
Targeted protein degrader structure, illustration