Dechlorane 602

CAS Registry Number®

31107-44-5
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CAS Name

Dechlorane 602

Molecular Formula

C14H4Cl12O

Molecular Mass

613.62

Cite this Page

Dechlorane 602.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=31107-44-5 (retrieved 2024-04-27) (CAS RN: 31107-44-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C14H4Cl12O/c15-3-5(17)11(21)7-1(9(3,19)13(11,23)24)2-8(27-7)12(22)6(18)4(16)10(2,20)14(12,25)26/h1-2,7-8H/t1-,2+,7+,8-,9-,10-,11-,12-/s2

InChIKey

InChIKey=CDBKZZACXQLFMK-GGFBBRRZNA-N

SMILES

Cl[C@]12[C@@]3([C@]4([C@@](O[C@@]3([C@](Cl)([C@]1(Cl)Cl)C(Cl)=C2Cl)[H])([C@]5(Cl)C(Cl)(Cl)[C@@]4(Cl)C(Cl)=C5Cl)[H])[H])[H]

Canonical SMILES

ClC1=C(Cl)C2(Cl)C3C(OC4C3C5(Cl)C(Cl)=C(Cl)C4(Cl)C5(Cl)Cl)C1(Cl)C2(Cl)Cl

Other Names for this Substance

  • 1,4:6,9-Dimethanodibenzofuran, 1,2,3,4,6,7,8,9,10,10,11,11-dodecachloro-1,4,4a,5a,6,9,9a,9b-octahydro-
  • 1,2,3,4,6,7,8,9,10,10,11,11-Dodecachloro-1,4,4a,5a,6,9,9a,9b-octahydro-1,4:6,9-dimethanodibenzofuran
  • Dechlorane 602
  • Dec 602

Deleted or Replaced CAS Registry Numbers

56449-79-7, 1482458-42-3

CAS INSIGHTSTM
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