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Substance Name: 1,5-Pentanedione, 1,5-bis(4-(hexyloxy)phenyl)-, dioxime
RN: 104192-46-3
InChIKey: XBKWCUGGYSPRAN-BRMDCIMDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H42-N2-O4

Molecular Weight

  • 482.6608
 
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Names and Synonyms

Synonyms

  • 1,5-Bis(4-(hexyloxy)phenyl)-1,5-pentanedione dioxime
  • BRN 5661541

Systematic Name

  • 1,5-Pentanedione, 1,5-bis(4-(hexyloxy)phenyl)-, dioxime

Registry Numbers

CAS Registry Number

  • 104192-46-3

System Generated Number

  • 0104192463

Structure Descriptors

InChI

1S/C29H42N2O4/c1-3-5-7-9-22-34-26-18-14-24(15-19-26)28(30-32)12-11-13-29(31-33)25-16-20-27(21-17-25)35-23-10-8-6-4-2/h14-21,32-33H,3-13,22-23H2,1-2H3/b30-28-,31-29-

InChIKey

XBKWCUGGYSPRAN-BRMDCIMDSA-N

Smiles

CCCCCCOc1ccc(cc1)/C(=N\O)/CCC/C(=N/O)/c2ccc(cc2)OCCCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal > 5gm/kg (5000mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 378, 1986.