Chemical Compound

Etoxadrol-2-isothiocyanate

CAS Registry Number 117994-64-6
Etoxadrol-2-isothiocyanate chemical structure
Primary Record

Etoxadrol-2-isothiocyanate

In stock
1,733 g
Purity
98.5 %
CAS
117994-64-6

Compound Identifiers & Properties

CAS
117994-64-6
PubChem CID
44144597
SMILES
CC[C@]1(OC[C@H](O1)[C@H]2CCCCN2)C3=CC(=CC=C3)N=C=S
Canonical SMILES
CC[C@@]1(c2cccc(N=C=S)c2)OC[C@@H]([C@H]2CCCCN2)O1

Names & Synonyms

  • Etoxadrol-2-isothiocyanate
  • Etoxadrol-meta-isothiocyanate
  • RefChem:139287
  • DTXSID20151987
  • DTXCID5074478
  • C17-H22-N2-O2-S
  • 117994-64-6
  • J356.764H
  • (2-Ethyl-2-(3-isothiocyanatophenyl)-2-piperidyl)-1,3-dioxolane
  • (2R)-2-[(2R,4R)-2-ethyl-2-(3-isothiocyanatophenyl)-1,3-dioxolan-4-yl]piperidine
  • Piperidine, 2-(2-ethyl-2-(3-isothiocyanatophenyl)-1,3-dioxolan-4-yl)-, (2S-(2alpha,4beta(R*)))-
  • 3-[4alpha-(Piperidin-2beta-yl)-2alpha-ethyl-1,3-dioxolan-2-yl]phenyl isothiocyanate