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Substance Name: Alanine, N,N-diethyl-, mesityl ester, L-, hydrochloride
RN: 2173-47-9
InChIKey: XEDFZSFSQQMFPZ-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Skin / Eye Irritant

Molecular Formula

  • C16-H25-N-O2.Cl-H

Molecular Weight

  • 299.839
 
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Names and Synonyms

Synonyms

  • FC 660
  • L-N,N-Diethylalanine mesityl ester hydrochloride

Systematic Name

  • Alanine, N,N-diethyl-, mesityl ester, L-, hydrochloride

Registry Numbers

CAS Registry Number

  • 2173-47-9

System Generated Number

  • 0002173479

Molecular Formulas

Molecular Formula

  • C16-H25-N-O2.Cl-H

Molecular Formula Fragments

  • C16-H25-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H25NO2.ClH/c1-7-17(8-2)14(6)16(18)19-15-12(4)9-11(3)10-13(15)5;/h9-10,14H,7-8H2,1-6H3;1H

InChIKey

XEDFZSFSQQMFPZ-UHFFFAOYSA-N

Smiles

c1(OC([C@@H]([NH+](CC)CC)C)=O)c(cc(C)cc1C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 2gm/kg (2000mg/kg)   Bollettino Chimico Farmaceutico. Vol. 107, Pg. 310, 1968.