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Substance Name: TEI 1365
RN: 148040-04-4
InChIKey: KWDFKWDTUPMVNM-UHFFFAOYSA-N

Molecular Formula

  • C16-H13-F-N2-O6

Molecular Weight

  • 348.2847
 
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Names and Synonyms

Results Name

  • TEI 1365

Synonyms

  • 4-(2-Fluoro-5-nitrophenyl)-3-methoxycarbonyl-2,6-dimethyl-5-pyridinecarboxylic acid
  • Monomethyl 2,6-dimethyl-4-(2-fluoro-5-nitrophenyl)-3,5-pyridinedicarboxylate
  • TEI-1365

Systematic Name

  • 3,5-Pyridinedicarboxylic acid, 2,6-dimethyl-4-(2-fluoro-5-nitrophenyl)-, monomethyl ester

Registry Numbers

CAS Registry Number

  • 148040-04-4

System Generated Number

  • 0148040044

Structure Descriptors

InChI

1S/C16H13FN2O6/c1-7-12(15(20)21)14(13(8(2)18-7)16(22)25-3)10-6-9(19(23)24)4-5-11(10)17/h4-6H,1-3H3,(H,20,21)

InChIKey

KWDFKWDTUPMVNM-UHFFFAOYSA-N

Smiles

Cc1c(c(c(c(n1)C)C(=O)OC)c2cc(ccc2F)[N+](=O)[O-])C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral > 2gm/kg (2000mg/kg)   Kiso to Rinsho. Clinical Report. Vol. 26, Pg. 2223, 1992.