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Substance Name: Ethanol, 2-(N-9-acridinyl-p-1,2-dicarbadodecaboran(12)-1-ylanilino)-, hydrochloride
RN: 101221-44-7
InChIKey: NWZFUHYJXSJJPZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H28-B10-N2-O.Cl-H

Molecular Weight

  • 493.0581
 
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Names and Synonyms

Synonyms

  • 2-(N-9-Acridinyl-p-1,2-dicarbadodecaboran(12)-1-ylanilino)ethanol hydrochloride
  • N,N-(2-Hydroxyethyl-p-carboranylphenyl)-9-aminoacridine hydrochloride

Systematic Name

  • Ethanol, 2-(N-9-acridinyl-p-1,2-dicarbadodecaboran(12)-1-ylanilino)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 101221-44-7

System Generated Number

  • 0101221447

Molecular Formulas

Molecular Formula

  • C23-H28-B10-N2-O.Cl-H

Molecular Formula Fragments

  • C23-H28-B10-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H28B10N2O.ClH/c36-14-13-15-9-11-16(12-10-15)35(21-17-5-1-3-7-19(17)34-20-8-4-2-6-18(20)21)23-22-24(23)26(22)27(22)25(22,23)29(23)28(23,24)30(24,26)32(26,27)31(25,27,29)33(28,29,30)32;/h1-12,22,24-33,36H,13-14H2;1H

InChIKey

NWZFUHYJXSJJPZ-UHFFFAOYSA-N

Smiles

[BH]1234[BH]567[BH]189[BH]212[BH]33%10[BH]454[BH]656[BH]787[BH]911[CH]232[BH]4%105C7612N(c1ccc(cc1)CCO)c1c2ccccc2nc2c1cccc2.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 180mg/kg (180mg/kg)   Journal of Medicinal Chemistry. Vol. 10, Pg. 730, 1967.