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Substance Name: Alanine, N-benzyloxycarbonyl-3,3-dimethyl-, 1,2-dibromoethyl ester, L-
RN: 73680-51-0
InChIKey: JGURDZWILNYABV-ABLWVSNPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H19-Br2-N-O4

Molecular Weight

  • 437.126
 
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Names and Synonyms

Synonym

  • L-N-Benzyloxycarbonyl-3,3-dimethylalanine 1,2-dibromoethyl ester

Systematic Name

  • Alanine, N-benzyloxycarbonyl-3,3-dimethyl-, 1,2-dibromoethyl ester, L-

Registry Numbers

CAS Registry Number

  • 73680-51-0

System Generated Number

  • 0073680510

Structure Descriptors

InChI

1S/C15H19Br2NO4/c1-10(2)13(14(19)22-12(17)8-16)18-15(20)21-9-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3,(H,18,20)/t12?,13-/m0/s1

InChIKey

JGURDZWILNYABV-ABLWVSNPSA-N

Smiles

N([C@H](C(O[C@@H](CBr)Br)=O)C(C)C)C(OCc1ccccc1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 219mg/kg (219mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1584, 1977.