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Substance Name: Valeric acid, 2-(m-(2-(3-amino-2,4,6-triiodophenyl)acetamido)phenoxy)-
RN: 22714-25-6
InChIKey: MWIJULOLZFZDSQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H11-I3-N2-O4

Molecular Weight

  • 720.0691
 
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Names and Synonyms

Synonyms

  • 2-(m-(2-(3-Amino-2,4,6-triiodophenyl)acetamido)phenoxy)valeric acid
  • alpha-(3-(3-Amino-2,4,6-trijod-phenacetylamino)-phenoxy)-valeriansaure
  • alpha-(3-(3-Amino-2,4,6-trijod-phenacetylamino)-phenoxy)-valeriansaure [German]
  • Pentanoic acid, 2-(3-(((3-amino-2,4,6-triiodophenyl)acetyl)amino)phenoxy)-

Systematic Name

  • Valeric acid, 2-(m-(2-(3-amino-2,4,6-triiodophenyl)acetamido)phenoxy)-

Registry Numbers

CAS Registry Number

  • 22714-25-6

System Generated Number

  • 0022714256

Structure Descriptors

InChI

1S/C19H19I3N2O4/c1-2-4-15(19(26)27)28-11-6-3-5-10(7-11)24-16(25)8-12-13(20)9-14(21)18(23)17(12)22/h3,5-7,9,15H,2,4,8,23H2,1H3,(H,24,25)(H,26,27)

InChIKey

MWIJULOLZFZDSQ-UHFFFAOYSA-N

Smiles

CCCC(C(=O)O)Oc1cccc(c1)NC(=O)Cc2c(cc(c(c2I)N)I)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 4gm/kg (4000mg/kg)   Helvetica Chimica Acta. Vol. 52, Pg. 1339, 1969.