Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzoic acid, 3-methoxy-4-propoxythio-, O-ethyl ester
RN: 117666-91-8
InChIKey: RVHZEQAPVWWXID-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H18-O3-S

Molecular Weight

  • 254.3482
 
* 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

  • 3-Methoxy-4-propoxythiobenzoic acid O-ethyl ester
  • Benzenecarbothioic acid, 3-methoxy-4-propoxy-, O-ethyl ester

Systematic Name

  • Benzoic acid, 3-methoxy-4-propoxythio-, O-ethyl ester

Registry Numbers

CAS Registry Number

  • 117666-91-8

System Generated Number

  • 0117666918

Structure Descriptors

InChI

1S/C13H18O3S/c1-4-8-16-11-7-6-10(13(14)17)9(5-2)12(11)15-3/h6-7H,4-5,8H2,1-3H3,(H,14,17)

InChIKey

RVHZEQAPVWWXID-UHFFFAOYSA-N

Smiles

CCCOc1ccc(c(c1OC)CC)C(=S)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 967mg/kg (967mg/kg)   Farmaco, Edizione Scientifica. Vol. 43, Pg. 551, 1988.