Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 3-((10-Ethyl-11-(4-hydroxyphenyl)dibenz(b,f)oxepin-3-yl)oxy)1,2-propanediol
RN: 85850-93-7
UNII: Y5HIG0VGOH
InChIKey: JJRNTCBZXIPXTL-UHFFFAOYSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C25-H24-O5.1/4H2-O

Molecular Weight

  • 404.4596
 
* 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

  • 3-((10-Ethyl-11-(4-hydroxyphenyl)dibenz(b,f)oxepin-3-yl)oxy)1,2-propanediol

Synonyms

  • 3-((10-Ethyl-11-(p-hydroxyphenyl)dibenz(b,f)oxepin-3-yl)oxy)-1,2-propanediol hydrate (4:1)
  • UNII-Y5HIG0VGOH

Systematic Name

  • 1,2-Propanediol, 3-((10-ethyl-11-(p-hydroxyphenyl)dibenz(b,f)oxepin-3-yl)oxy)-, hydrate (4:1)

Registry Numbers

CAS Registry Number

  • 85850-93-7

FDA UNII

  • Y5HIG0VGOH

System Generated Number

  • 0085850937

Molecular Formulas

Molecular Formula

  • C25-H24-O5.1/4H2-O

Molecular Formula Fragments

  • C25-H24-O5
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C25H24O5/c1-2-20-21-5-3-4-6-23(21)30-24-13-19(29-15-18(28)14-26)11-12-22(24)25(20)16-7-9-17(27)10-8-16/h3-13,18,26-28H,2,14-15H2,1H3

InChIKey

JJRNTCBZXIPXTL-UHFFFAOYSA-N

Smiles

CCC1=C(c2ccc(cc2Oc3c1cccc3)OCC(CO)O)c4ccc(cc4)O