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Substance Name: 2,4,6-Cycloheptatrien-1-one, 3-carboxy-2-hydroxy-
RN: 33739-60-5
InChIKey: XSQOERZXJVUACX-UHFFFAOYSA-N

Molecular Weight

  • 166.131
 
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Names and Synonyms

Synonym

  • 3-Carboxy-tropolone

Systematic Name

  • 2,4,6-Cycloheptatrien-1-one, 3-carboxy-2-hydroxy-

Registry Numbers

CAS Registry Number

  • 33739-60-5

System Generated Number

  • 0033739605

Structure Descriptors

InChI

1S/C8H6O4/c9-6-4-2-1-3-5(7(6)10)8(11)12/h1-4H,(H,9,10)(H,11,12)

InChIKey

XSQOERZXJVUACX-UHFFFAOYSA-N

Smiles

c1(c(c(cccc1)=O)O)C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 479mg/kg (479mg/kg)   Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 53, Pg. 918, 1957.