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Substance Name: Xanthene-9-acetic acid, 2-(dicyclohexylamino)ethyl ester, hydrochloride
RN: 103161-33-7
InChIKey: LDEYCVXORPJJKX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H37-N-O3.Cl-H

Molecular Weight

  • 484.0762
 
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Names and Synonyms

Synonyms

  • 2-(Dicyclohexylamino)ethyl xanthene-9-acetate hydrochloride
  • 2-Dicyclohexylaminoethyl 9-xanthenylacetate hydrochloride

Systematic Name

  • Xanthene-9-acetic acid, 2-(dicyclohexylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 103161-33-7

System Generated Number

  • 0103161337

Molecular Formulas

Molecular Formula

  • C29-H37-N-O3.Cl-H

Molecular Formula Fragments

  • C29-H37-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

InChI=1S/C29H37NO3.ClH/c31-29(21-26-24-15-7-9-17-27(24)33-28-18-10-8-16-25(26)28)32-20-19-30(22-11-3-1-4-12-22)23-13-5-2-6-14-23;/h7-10,15-18,22-23,26H,1-6,11-14,19-21H2;1H

InChIKey

LDEYCVXORPJJKX-UHFFFAOYSA-N

Smiles

Cl.O=C(CC1c2ccccc2Oc3ccccc13)OCCN(C4CCCCC4)C5CCCCC5

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 54600ug/kg (54.6mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 77, Pg. 1145, 1957.