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Substance Name: Aquathol disodium
RN: 6385-60-0
UNII: 5SG2WQT857
InChIKey: ZRHKGBGEZJYZAY-RCEHDPCYSA-L

Classification Codes

  • Agricultural Chemical
  • Experimental Pesticide
  • Unspecified / Unclassified Pesticide

Molecular Formulas

  • C8-H6-O5.2Na
  • C8-H8-O5.2Na

Molecular Weight

  • 228.11
 
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Names and Synonyms

Results Name

  • Aquathol disodium

Name of Substance

  • Disodium 7-oxabicyclo(2.2.1)hept-5-ene-2,3-dicarboxylate, (endo,endo)-

Synonyms

  • (endo,endo)-Disodium 7-Oxabicyclo(2.2.1)hept-5-ene-2,3-dicarboxylate
  • Aquathol disodium
  • EINECS 228-984-9
  • UNII-5SG2WQT857

Systematic Names

  • 7-Oxabicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, disodium salt, (endo)-
  • 7-Oxabicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, disodium salt, (endo,endo)-
  • Disodium (endo,endo)-7-oxabicyclo(2.2.1)hept-5-ene-2,3-dicarboxylate

Registry Numbers

CAS Registry Number

  • 6385-60-0

FDA UNII

  • 5SG2WQT857

Related Registry Number

  • 66330-88-9 (Parent)

System Generated Number

  • 0006385600

Molecular Formulas

Molecular Formulas

  • C8-H6-O5.2Na
  • C8-H8-O5.2Na

Molecular Formula Fragments

  • C8-H6-O5
  • C8-H8-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C8H8O5.2Na/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12;;/h1-6H,(H,9,10)(H,11,12);;/q;2*+1/p-2/t3-,4+,5+,6-;;

InChIKey

ZRHKGBGEZJYZAY-RCEHDPCYSA-L

Smiles

C=1[C@@H]2O[C@H](C1)[C@@H](C(=O)[O-])[C@@H]2C(=O)[O-].[Na+].[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo oral 182mg/kg (182mg/kg)   Pesticide Chemicals Official Compendium, Association of the American Pesticide Control Officials, Inc., 1966. Vol. -, Pg. 471, 1966.