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Substance Name: L-Proline, 1-((2,6-dichlorophenyl)methyl)-5-oxo-, compd. with 2-propanamine (1:1)
RN: 59749-39-2
InChIKey: KQQFXEADOPSTOY-PPHPATTJSA-N

Molecular Formula

  • C12-H11-Cl2-N-O3.C3-H9-N

Molecular Weight

  • 347.24
 
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Names and Synonyms

Synonyms

  • 1-((2,6-Dichlorophenyl)methyl)-5-oxo-L-proline compd. with 2-propanamine (1:1)
  • N-(Dichloro-2',6' benzyl)pyroglutamate de d'isopropylamine
  • N-(Dichloro-2',6' benzyl)pyroglutamate de d'isopropylamine [French]

Systematic Name

  • L-Proline, 1-((2,6-dichlorophenyl)methyl)-5-oxo-, compd. with 2-propanamine (1:1)

Registry Numbers

CAS Registry Number

  • 59749-39-2

System Generated Number

  • 0059749392

Molecular Formulas

Molecular Formula

  • C12-H11-Cl2-N-O3.C3-H9-N

Molecular Formula Fragments

  • C12-H11-Cl2-N-O3
  • C3-H9-N
  • COMPONENT

Structure Descriptors

InChI

1S/C12H11Cl2NO3.C3H9N/c13-8-2-1-3-9(14)7(8)6-15-10(12(17)18)4-5-11(15)16;1-3(2)4/h1-3,10H,4-6H2,(H,17,18);3H,4H2,1-2H3/t10-;/m0./s1

InChIKey

KQQFXEADOPSTOY-PPHPATTJSA-N

Smiles

CC(C)N.c1cc(c(c(c1)Cl)CN2[C@@H](CCC2=O)C(=O)O)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1200mg/kg (1200mg/kg)   French Demande Patent Document. Vol. #2273533,