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Substance Name: 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(2-propynyl)-
RN: 54399-03-0
InChIKey: QLYIQGHYFPKJMV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H11-N-O2

Molecular Weight

  • 189.213
 
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Names and Synonyms

Synonyms

  • 3a,4,7,7a-Tetrahydro-2-(2-propynyl)-1H-isoindole-1,3(2H)-dione
  • 5-21-10-00131 (Beilstein Handbook Reference)
  • BRN 1455769
  • N-Propargilo imid kwasu 1,2,3,6-tetrahydroftalowego
  • N-Propargilo imid kwasu 1,2,3,6-tetrahydroftalowego [Polish]

Systematic Name

  • 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(2-propynyl)-

Registry Numbers

CAS Registry Number

  • 54399-03-0

System Generated Number

  • 0054399030

Structure Descriptors

InChI

1S/C11H11NO2/c1-2-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h1,3-4,8-9H,5-7H2

InChIKey

QLYIQGHYFPKJMV-UHFFFAOYSA-N

Smiles

C1([C@@H]2[C@@H](C(=O)N1CC#C)CC=CC2)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg) BEHAVIORAL: EXCITEMENT

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION
Acta Poloniae Pharmaceutica. For English translation, see APPFAR. Vol. 31, Pg. 401, 1974.