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Substance Name: 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic acid, diethyl ester, (exo,exo)-
RN: 109282-41-9
InChIKey: XMTANUFQUTUZGE-FIRGSJFUSA-N

Classification Codes

  • Agricultural Chemical
  • Herbicide

Molecular Formula

  • C12-H18-O5

Molecular Weight

  • 242.269
 
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Names and Synonyms

Synonyms

  • (exo,exo)-Diethyl 7-oxabicyclo(2.2.1)heptane-2,3-dicarboxylate
  • 5-18-07-00033 (Beilstein Handbook Reference)
  • BRN 1251737

Systematic Name

  • 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic acid, diethyl ester, (exo,exo)-

Registry Numbers

CAS Registry Number

  • 109282-41-9

System Generated Number

  • 0109282419

Structure Descriptors

InChI

1S/C12H18O5/c1-3-15-11(13)9-7-5-6-8(17-7)10(9)12(14)16-4-2/h7-10H,3-6H2,1-2H3/t7-,8+,9+,10-

InChIKey

XMTANUFQUTUZGE-FIRGSJFUSA-N

Smiles

O1[C@@H]2CC[C@H]1[C@H]([C@H]2C(OCC)=O)C(OCC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 50mg/kg (50mg/kg)   Journal of Agricultural and Food Chemistry. Vol. 35, Pg. 823, 1987.