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Substance Name: Dechlorane plus
RN: 13560-89-9
UNII: 193G0ER097
InChIKey: UGQQAJOWXNCOPY-UHFFFAOYSA-N

Note

  • A flame retardant.

Molecular Formula

  • C18-H12-Cl12

Molecular Weight

  • 653.729
 
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Names and Synonyms

Name of Substance

  • Dechlorane plus

Synonyms

  • 4-05-00-01783 (Beilstein Handbook Reference)
  • AI3-27889
  • Bis(hexachlorocyclopentadieno)cyclooctane
  • BRN 2195908
  • Dechloran A
  • Dechlorane 605
  • Dechlorane plus
  • Dechlorane Plus 1000
  • Dechlorane Plus 25
  • Dechlorane Plus 2520
  • Dechlorane Plus 35
  • Dechlorane Plus 515
  • Dodecachlorododecahydrodimethanodibenzocyclooctane
  • EC 236-948-9
  • EINECS 236-948-9
  • HSDB 7450
  • UNII-193G0ER097

Systematic Names

  • 1,4:7,10-Dimethanodibenzo(a,e)cyclooctane, 1,2,3,4,7,8,9,10,13,13,14,14-dodecachloro-1,4,4a,5,6,6a,7,10,10a,11,12,12a-dodecahydro-
  • 1,4:7,10-Dimethanodibenzo(a,e)cyclooctene, 1,2,3,4,7,8,9,10,13,13,14,14-dodecachloro-1,4,4a,5,6,6a,7,10,10a,11,12,12a-dodecahydro-
  • 1,6,7,8,9,14,15,16,17,17,18,18-Dodecachloropentacyclo(12.2.1.16,9.02,13.05,10)octadeca-7,15-diene

Superlist Name

  • 1,4:7,10-Dimethanodibenzo(a,e)cyclooctene, 1,2,3,4,7,8,9,10,13,13,14,14-dodecachloro-1,4,4a,5,6,6a,7,10,10a,11,12,12a-dodecahydro-

Registry Numbers

CAS Registry Number

  • 13560-89-9

FDA UNII

  • 193G0ER097

Other Registry Numbers

  • 11114-14-0
  • 1195618-74-6
  • 39386-10-2
  • 40372-58-5
  • 59459-11-9
  • 60880-74-2

System Generated Number

  • 0013560899

Structure Descriptors

InChI

1S/C18H12Cl12/c19-9-10(20)15(25)7-3-4-8-6(2-1-5(7)13(9,23)17(15,27)28)14(24)11(21)12(22)16(8,26)18(14,29)30/h5-8H,1-4H2

InChIKey

UGQQAJOWXNCOPY-UHFFFAOYSA-N

Smiles

C1([C@@]2([C@@H]3[C@@H](CC[C@@H]4[C@@]5(C(Cl)=C([C@@]([C@@H]4CC3)(C5(Cl)Cl)Cl)Cl)Cl)[C@@]1(Cl)C(=C2Cl)Cl)Cl)(Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 11848mg/kg (11848mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Science Reports of the Research Institutes, Tohoku University, Series C: Medicine. Vol. 36(1-4), Pg. 10, 1989.
rabbit LD50 skin 8gm/kg (8000mg/kg)   Personal Communication from L. Little, Occidental Chemical Corp., Hooker Chemical Center, 360 Rainbow Blvd. South, Box 728, Niagara Falls, NY 14302, May 6, 1985Vol. 06MAY1985,
rat LC50 inhalation 2250mg/m3 (2250mg/m3)   Personal Communication from L. Little, Occidental Chemical Corp., Hooker Chemical Center, 360 Rainbow Blvd. South, Box 728, Niagara Falls, NY 14302, May 6, 1985Vol. 06MAY1985,
rat LD50 oral 25gm/kg (25000mg/kg)   Personal Communication from L. Little, Occidental Chemical Corp., Hooker Chemical Center, 360 Rainbow Blvd. South, Box 728, Niagara Falls, NY 14302, May 6, 1985Vol. 06MAY1985,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point >325 deg C   EXP
log P (octanol-water) 11.27 (none)   EST
Atmospheric OH Rate Constant 2.29E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.