Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Octanoic acid, 2-(4-(4-((1-(ethoxycarbonyl)heptyl)oxy)-3-methylphenoxy)phenoxy)-, ethyl ester
RN: 70886-49-6
InChIKey: OJGAFCIRHQKWBM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C33-H48-O7

Molecular Weight

  • 556.7352
 
* 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

Synonyms

  • ((Ethoxycarbonyl-1 heptyloxy)-4 phenoxy)-4' methyl-2' phenoxy-2 octanoate d'ethyle
  • ((Ethoxycarbonyl-1 heptyloxy)-4 phenoxy)-4' methyl-2' phenoxy-2 octanoate d'ethyle [French]
  • Ethyl 2-(4-(4-((1-(ethoxycarbonyl)heptyl)oxy)-3-methylphenoxy)phenoxy)octanoate

Systematic Name

  • Octanoic acid, 2-(4-(4-((1-(ethoxycarbonyl)heptyl)oxy)-3-methylphenoxy)phenoxy)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 70886-49-6

System Generated Number

  • 0070886496

Structure Descriptors

InChI

1S/C33H48O7/c1-6-10-12-14-16-30(32(34)36-8-3)39-27-20-18-26(19-21-27)38-28-22-23-29(25(5)24-28)40-31(33(35)37-9-4)17-15-13-11-7-2/h18-24,30-31H,6-17H2,1-5H3

InChIKey

OJGAFCIRHQKWBM-UHFFFAOYSA-N

Smiles

CCCCCCC(C(=O)OCC)Oc1ccc(cc1)Oc2ccc(c(c2)C)OC(CCCCCC)C(=O)OCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   French Demande Patent Document. Vol. #2381017,