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Substance Name: 2-Pyrrolidinecarboxylic acid, 1-hydroxy-, 1,2-dibromoethyl ester, benzoate, L-
RN: 74039-33-1
InChIKey: AKMPBAGLPBVDJC-PXYINDEMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-Br2-N-O4

Molecular Weight

  • 421.0835
 
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Names and Synonyms

Synonym

  • L-1-Benzyloxycarbonyl-2-pyrrolidinecarboxylic acid

Systematic Name

  • 2-Pyrrolidinecarboxylic acid, 1-hydroxy-, 1,2-dibromoethyl ester, benzoate, L-

Registry Numbers

CAS Registry Number

  • 74039-33-1

System Generated Number

  • 0074039331

Structure Descriptors

InChI

1S/C14H15Br2NO4/c15-9-12(16)20-14(19)11-7-4-8-17(11)21-13(18)10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9H2/t11-,12?/m0/s1

InChIKey

AKMPBAGLPBVDJC-PXYINDEMSA-N

Smiles

c1ccc(cc1)C(=O)ON2CCC[C@H]2C(=O)OC(CBr)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 83mg/kg (83mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1584, 1977.