Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Exepanol [INN]
RN: 77416-65-0
UNII: 5CF9F84B3A
InChIKey: JWUPWOYNGNTOKD-WCBMZHEXSA-N

Molecular Formula

  • C11-H15-N-O2

Molecular Weight

  • 193.245
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Exepanol
  • Exepanol [INN]

Synonyms

  • Exepanol
  • Exepanolum
  • Exepanolum [INN-Latin]
  • UNII-5CF9F84B3A

Systematic Names

  • (+-)-cis-2,3,4,5-Tetrahydro-3-(methylamino)-1-benzoxepin-5-ol
  • 1-Benzoxepin-5-ol, 2,3,4,5-tetrahydro-3-(methylamino)-, cis-(+-)-

Registry Numbers

CAS Registry Number

  • 77416-65-0

FDA UNII

  • 5CF9F84B3A

System Generated Number

  • 0077416650

Structure Descriptors

InChI

1S/C11H15NO2/c1-12-8-6-10(13)9-4-2-3-5-11(9)14-7-8/h2-5,8,10,12-13H,6-7H2,1H3/t8-,10+/m0/s1

InChIKey

JWUPWOYNGNTOKD-WCBMZHEXSA-N

Smiles

c12[C@@H](C[C@@H](COc2cccc1)NC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 342mg/kg (342mg/kg)   United States Patent Document. Vol. #4279904,