Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1H-Pyrazole-4-carboxylic acid, 5-cyano-1-(3-methylphenyl)-, ethyl ester
RN: 98476-13-2
InChIKey: ABGIIDLTTLKRLV-UHFFFAOYSA-N

Molecular Formula

  • C14-H13-N3-O2

Molecular Weight

  • 255.276
 
* 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

  • Ethyl 5-cyano-1-(3-methylphenyl)-1H-pyrazole-4-carboxylate

Systematic Name

  • 1H-Pyrazole-4-carboxylic acid, 5-cyano-1-(3-methylphenyl)-, ethyl ester

Registry Numbers

CAS Registry Number

  • 98476-13-2

System Generated Number

  • 0098476132

Structure Descriptors

InChI

1S/C14H13N3O2/c1-3-19-14(18)12-9-16-17(13(12)8-15)11-6-4-5-10(2)7-11/h4-7,9H,3H2,1-2H3

InChIKey

ABGIIDLTTLKRLV-UHFFFAOYSA-N

Smiles

n1(ncc(c1C#N)C(=O)OCC)c1cc(ccc1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 500mg/kg (500mg/kg) SENSE ORGANS AND SPECIAL SENSES: CHROMODACYRORREA: EYE

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
National Technical Information Service. Vol. OTS0544607,