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Substance Name: 3H-2-Benzopyran-7-carboxylic acid, 4,6-dihydro-5-chloro-8-hydroxy-3-methyl-6-oxo-4-(trifluoromethyl)-
RN: 142689-03-0
InChIKey: VOFCTZBFOUAPOD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H8-Cl-F3-O5

Molecular Weight

  • 324.6372
 
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Names and Synonyms

  • 3H-2-Benzopyran-7-carboxylic acid, 4,6-dihydro-5-chloro-8-hydroxy-3-methyl-6-oxo-4-(trifluoromethyl)-

Registry Numbers

CAS Registry Number

  • 142689-03-0

System Generated Number

  • 0142689030

Structure Descriptors

InChI

1S/C12H8ClF3O5/c1-3-7(12(14,15)16)5-4(2-21-3)9(17)6(11(19)20)10(18)8(5)13/h2-3,7,17H,1H3,(H,19,20)

InChIKey

VOFCTZBFOUAPOD-UHFFFAOYSA-N

Smiles

CC1C(C2=C(C(=O)C(=C(C2=CO1)O)C(=O)O)Cl)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 8gm/kg (8000mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #92-69337,