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Substance Name: Carbonic acid, hexyl 2-((4-iodophenyl)methyl)hexyl ester
RN: 60075-89-0
InChIKey: LHFWDBQOCNGYEW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H31-I-O3

Molecular Weight

  • 446.3619
 
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Names and Synonyms

Synonyms

  • BRN 2004657
  • Hexyl 2-((4-iodophenyl)methyl)hexyl carbonate

Systematic Name

  • Carbonic acid, hexyl 2-((4-iodophenyl)methyl)hexyl ester

Registry Numbers

CAS Registry Number

  • 60075-89-0

System Generated Number

  • 0060075890

Structure Descriptors

InChI

1S/C20H31IO3/c1-3-5-7-8-14-23-20(22)24-16-18(9-6-4-2)15-17-10-12-19(21)13-11-17/h10-13,18H,3-9,14-16H2,1-2H3

InChIKey

LHFWDBQOCNGYEW-UHFFFAOYSA-N

Smiles

CCCCCCOC(=O)OCC(CCCC)Cc1ccc(cc1)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 15mL/kg (15mL/kg)   Journal of Medicinal Chemistry. Vol. 19, Pg. 1362, 1976.