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Substance Name: 5-Methylisatin
RN: 608-05-9
InChIKey: VAJCSPZKMVQIAP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H7-N-O2

Molecular Weight

  • 161.159
 
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Names and Synonyms

Name of Substance

  • 5-Methylisatin

Synonyms

  • 5-21-11-00179 (Beilstein Handbook Reference)
  • 5-Methyl-1H-indole-2,3-dione
  • 5-Methyl-indole-2,3-dione
  • 5-Methylisatin
  • BRN 0123738
  • EINECS 210-152-1
  • Isatin, 5-methyl- (6CI)
  • NSC 9398

Systematic Names

  • 1H-Indole-2,3-dione, 5-methyl- (9CI)
  • 5-Methylindole-2,3(1H)-dione
  • Indole-2,3-dione, 5-methyl-

Registry Numbers

CAS Registry Number

  • 608-05-9

System Generated Number

  • 0000608059

Structure Descriptors

InChI

1S/C9H7NO2/c1-5-2-3-7-6(4-5)8(11)9(12)10-7/h2-4H,1H3,(H,10,11,12)

InChIKey

VAJCSPZKMVQIAP-UHFFFAOYSA-N

Smiles

c12c(N=C(C1=O)O)ccc(c2)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 790mg/kg (790mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION Pharmaceutical Chemistry Journal Vol. 15, Pg. 858, 1981.