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Substance Name: Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester
RN: 102395-66-4
InChIKey: GFXQTCCWCSVYAN-UHFFFAOYSA-N

Molecular Formula

  • C20-H23-N-O3

Molecular Weight

  • 325.4057
 
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Names and Synonyms

Synonym

  • Diphenylmethyl 4-hydroxy-1-methylisonipecotate

Systematic Name

  • Isonipecotic acid, 4-hydroxy-1-methyl-, diphenylmethyl ester

Registry Numbers

CAS Registry Number

  • 102395-66-4

System Generated Number

  • 0102395664

Structure Descriptors

InChI

1S/C20H23NO3/c1-21-14-12-20(23,13-15-21)19(22)24-18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18,23H,12-15H2,1H3

InChIKey

GFXQTCCWCSVYAN-UHFFFAOYSA-N

Smiles

CN1CCC(CC1)(C(=O)OC(c2ccccc2)c3ccccc3)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#11707,