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Substance Name: Alanine, N,N-diethyl-, 2,6-diethylphenyl ester, L-, hydrochloride
RN: 2282-89-5
InChIKey: OVQHNONIYUKUIV-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Skin / Eye Irritant

Molecular Formula

  • C17-H27-N-O2.Cl-H

Molecular Weight

  • 313.866
 
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Names and Synonyms

Synonyms

  • FC 642
  • L-N,N-Diethylalanine 2,6-diethylphenyl ester hydrochloride

Systematic Name

  • Alanine, N,N-diethyl-, 2,6-diethylphenyl ester, L-, hydrochloride

Registry Numbers

CAS Registry Number

  • 2282-89-5

System Generated Number

  • 0002282895

Molecular Formulas

Molecular Formula

  • C17-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C17-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H27NO2.ClH/c1-6-14-11-10-12-15(7-2)16(14)20-17(19)13(5)18(8-3)9-4;/h10-13H,6-9H2,1-5H3;1H

InChIKey

OVQHNONIYUKUIV-UHFFFAOYSA-N

Smiles

c1(c(cccc1CC)CC)OC([C@@H]([NH+](CC)CC)C)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 1750mg/kg (1750mg/kg)   Bollettino Chimico Farmaceutico. Vol. 107, Pg. 310, 1968.