Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,3-Propanediol, 2,2-diethyl-, monocarbanilate
RN: 25451-67-6
InChIKey: DDIKSWFSVQZAAC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H21-N-O3

Molecular Weight

  • 251.324
 
* 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

Synonym

  • 2,2-Diethyl-1,3-propanediol monocarbanilate

Systematic Name

  • 1,3-Propanediol, 2,2-diethyl-, monocarbanilate

Registry Numbers

CAS Registry Number

  • 25451-67-6

System Generated Number

  • 0025451676

Structure Descriptors

InChI

1S/C14H21NO3/c1-3-14(4-2,10-16)11-18-13(17)15-12-8-6-5-7-9-12/h5-9,16H,3-4,10-11H2,1-2H3,(H,15,17)

InChIKey

DDIKSWFSVQZAAC-UHFFFAOYSA-N

Smiles

C(C(CO)(CC)CC)OC(Nc1ccccc1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 420mg/kg (420mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)" Journal of Medicinal Chemistry. Vol. 12, Pg. 462, 1969.