2,3,7,8-Tetrachlorodibenzo[b,e][1,4]dioxin-13C12

CAS Registry Number®

76523-40-5

CAS Name

2,3,7,8-Tetrachlorodibenzo[b,e][1,4]dioxin-13C12

Molecular Formula

C12H4Cl4O2

Cite this Page

2,3,7,8-Tetrachlorodibenzo[b,e][1,4]dioxin-13C12.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=76523-40-5 (retrieved 2024-11-24) (CAS RN: 76523-40-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H4Cl4O2/c13-5-1-9-10(2-6(5)14)18-12-4-8(16)7(15)3-11(12)17-9/h1-4H/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1

InChIKey

InChIKey=HGUFODBRKLSHSI-WCGVKTIYSA-N

SMILES

Cl[13C]=1[13CH]=[13C]2[13C](O[13C]=3[13C](O2)=[13CH][13C](Cl)=[13C](Cl)[13CH]3)=[13CH][13C]1Cl

Canonical SMILES

ClC=1C=C2OC3=CC(Cl)=C(Cl)C=C3OC2=CC1Cl

Other Names for this Substance

  • Dibenzo[b,e][1,4]dioxin-13C12, 2,3,7,8-tetrachloro-
  • 2,3,7,8-Tetrachlorodibenzo[b,e][1,4]dioxin-13C12
  • 2,3,7,8-TCDD-13C12

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