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Substance Name: Copper abietate
RN: 25986-23-6
UNII: 7D2Y8X4687
InChIKey: BCYMZMFCJMHEBD-JHZYRPMRSA-L

Molecular Formula

  • C20-H30-O2.1/2Cu

Molecular Weight

  • 666.4402
 
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Names and Synonyms

Results Name

  • Copper abietate

Name of Substance

  • Cupric abietate

Synonyms

  • Caswell No. 228
  • Copper abietate
  • EINECS 247-393-7
  • EPA Pesticide Chemical Code 023301
  • UNII-7D2Y8X4687

Systematic Name

  • Copper bis(1R-(1alpha,4aalpha,4bbeta,10abeta))-1,2,3,4,4a,5,6,10,10a-decahydro-7-isopropyl-1,4a-dimethylphenanthren-1-carboxylate

Registry Numbers

CAS Registry Number

  • 25986-23-6

FDA UNII

  • 7D2Y8X4687

System Generated Number

  • 0025986236

Molecular Formulas

Molecular Formula

  • C20-H30-O2.1/2Cu

Molecular Formula Fragments

  • C20-H30-O2
  • COMPONENT
  • Cu

Structure Descriptors

InChI

1S/2C20H30O2.Cu/c2*1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22;/h2*7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22);/q;;+2/p-2/t2*16-,17+,19+,20+;/m00./s1

InChIKey

BCYMZMFCJMHEBD-JHZYRPMRSA-L

Smiles

[Cu+2].CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C(=O)[O-])[C@H]2CC1.CC(C)C4=CC5=CC[C@@H]6[C@](C)(CCC[C@@]6(C)C(=O)[O-])[C@H]5CC4