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Substance Name: 2,4,6-Cycloheptatrien-1-one, 2-chloro-
RN: 3839-48-3
InChIKey: MTHNMAUDCHXFMM-UHFFFAOYSA-N

Molecular Formula

  • C7-H5-Cl-O

Molecular Weight

  • 140.568
 
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Names and Synonyms

Synonyms

  • 2-Chlorocycloheptatrienone
  • 2-Chlorotropone
  • 4-07-00-00502 (Beilstein Handbook Reference)
  • BRN 0471390
  • NSC 328816

Systematic Name

  • 2,4,6-Cycloheptatrien-1-one, 2-chloro-

Registry Numbers

CAS Registry Number

  • 3839-48-3

System Generated Number

  • 0003839483

Structure Descriptors

InChI

1S/C7H5ClO/c8-6-4-2-1-3-5-7(6)9/h1-5H

InChIKey

MTHNMAUDCHXFMM-UHFFFAOYSA-N

Smiles

c1(c(ccccc1)Cl)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 47mg/kg (47mg/kg)   Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 53, Pg. 918, 1957.
mouse LD50 subcutaneous 93mg/kg (93mg/kg)   Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 53, Pg. 918, 1957.