Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Acetic acid, (p-butoxyphenyl)-
RN: 4547-57-3
InChIKey: KLJMYYFCWBVKEE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-O3

Molecular Weight

  • 208.255
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • (p-Butoxyphenyl)acetic acid
  • 4-10-00-00544 (Beilstein Handbook Reference)
  • 4-Butoxybenzeneacetic acid
  • 4-Butoxyphenylacetic acid
  • 4-n-Butoxyphenylacetic acid
  • BRN 1105534
  • EINECS 224-904-1

Systematic Names

  • 4-Butoxyphenylacetic acid
  • Acetic acid, (p-butoxyphenyl)-
  • Benzeneacetic acid, 4-butoxy- (9CI)

Registry Numbers

CAS Registry Number

  • 4547-57-3

System Generated Number

  • 0004547573

Structure Descriptors

InChI

1S/C12H16O3/c1-2-3-8-15-11-6-4-10(5-7-11)9-12(13)14/h4-7H,2-3,8-9H2,1H3,(H,13,14)

InChIKey

KLJMYYFCWBVKEE-UHFFFAOYSA-N

Smiles

C(=O)(Cc1ccc(cc1)OCCCC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2gm/kg (2000mg/kg)   Research Progress in Organic-Biological and Medicinal Chemistry. Vol. 2, Pg. 32, 1970.