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Substance Name: Succinic acid, (5-chloro-2-benzoxazolinon-3-yl)methyl ester
RN: 63992-03-0
InChIKey: VMHZBJLIWFAJCX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H10-Cl-N-O6

Molecular Weight

  • 299.665
 
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Names and Synonyms

Synonym

  • 2-Benzoxazolinone, 5-chloro-3-(3-carboxypropionyloxy)methyl-

Systematic Name

  • Succinic acid, (5-chloro-2-benzoxazolinon-3-yl)methyl ester

Registry Numbers

CAS Registry Number

  • 63992-03-0

System Generated Number

  • 0063992030

Structure Descriptors

InChI

1S/C12H10ClNO6/c13-7-1-2-8-9(5-7)20-12(18)14(8)6-19-11(17)4-3-10(15)16/h1-2,5H,3-4,6H2,(H,15,16)

InChIKey

VMHZBJLIWFAJCX-UHFFFAOYSA-N

Smiles

n1(c(oc2c1ccc(Cl)c2)=O)COC(=O)CCC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 700mg/kg (700mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 340, 1964.
mouse LD50 oral 1500mg/kg (1500mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 340, 1964.
rat LD50 oral > 1gm/kg (1000mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 341, 1964.