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Substance Name: Acetic acid, ((2-bromo-4-(2-thienylcarbonyl)-1-naphthalenyl)oxy)-
RN: 68572-33-8
InChIKey: BTJBCKUIZOWOOH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H11-Br-O4-S

Molecular Weight

  • 391.2399
 
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Names and Synonyms

Synonym

  • ((2-Bromo-4-(2-thienylcarbonyl)-1-naphthalenyl)oxy)acetic acid

Systematic Name

  • Acetic acid, ((2-bromo-4-(2-thienylcarbonyl)-1-naphthalenyl)oxy)-

Registry Numbers

CAS Registry Number

  • 68572-33-8

System Generated Number

  • 0068572338

Structure Descriptors

InChI

1S/C17H11BrO4S/c18-13-8-12(16(21)14-6-3-7-23-14)10-4-1-2-5-11(10)17(13)22-9-15(19)20/h1-8H,9H2,(H,19,20)

InChIKey

BTJBCKUIZOWOOH-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)c(cc(c2OCC(=O)O)Br)C(=O)c3cccs3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4195093,