Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Hexanoic acid, 2-(3-(N-benzylacetamido)-2,4,6-triiodophenoxy)-
RN: 22275-41-8
InChIKey: IFFFEGDTQJLYGP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H22-I3-N-O4

Molecular Weight

  • 733.108
 
* 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

  • 2-(3-(N-Benzylacetamido)-2,4,6-triiodophenoxy)hexanoic acid
  • BRN 2683024

Systematic Name

  • Hexanoic acid, 2-(3-(N-benzylacetamido)-2,4,6-triiodophenoxy)-

Registry Numbers

CAS Registry Number

  • 22275-41-8

System Generated Number

  • 0022275418

Structure Descriptors

InChI

1S/C21H22I3NO4/c1-3-4-10-17(21(27)28)29-20-16(23)11-15(22)19(18(20)24)25(13(2)26)12-14-8-6-5-7-9-14/h5-9,11,17H,3-4,10,12H2,1-2H3,(H,27,28)

InChIKey

IFFFEGDTQJLYGP-UHFFFAOYSA-N

Smiles

c1(N(Cc2ccccc2)C(C)=O)c(c(O[C@@H](CCCC)C(O)=O)c(I)cc1I)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 146mg/kg (146mg/kg)   Farmaco, Edizione Scientifica. Vol. 24, Pg. 568, 1969.
mouse LD50 oral 1460mg/kg (1460mg/kg)   Farmaco, Edizione Scientifica. Vol. 24, Pg. 568, 1969.