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2,3,4,6,7,8-Hexachlorodibenzofuran-[13C12]

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General Information
Catalog: BLP-008034
CAS: 116843-05-1
Molecular Formula: [13C]12H2Cl6O
Molecular Weight: 386.74

Chemical Structure

Synonyms	2,3,4,6,7,8-Hexachlorodibenzofuran-13C12; 2,3,4,6,7,8-Hexachlorodibenzofuran-13C12; 2,3,4,6,7,8-HxCDF-13C12; PCDF 130-13C12
IUPAC Name	2,3,4,6,7,8-hexachlorodibenzo[b,d]furan-1,2,3,4,4a,5a,6,7,8,9,9a,9b-13C12
Related CAS	60851-34-5 (unlabelled)
Isomeric SMILES	[13CH]1=[13C]2[13C]3=[13CH][13C](=[13C]([13C](=[13C]3O[13C]2=[13C]([13C](=[13C]1Cl)Cl)Cl)Cl)Cl)Cl
Canonical SMILES	C1=C2C3=CC(=C(C(=C3OC2=C(C(=C1Cl)Cl)Cl)Cl)Cl)Cl
InChI	InChI=1S/C12H2Cl6O/c13-5-1-3-4-2-6(14)8(16)10(18)12(4)19-11(3)9(17)7(5)15/h1-2H/i1+1,2+1,3+1,4+1,5+1,6+1,7+1,8+1,9+1,10+1,11+1,12+1
InChI Key	XTAHLACQOVXINQ-WCGVKTIYSA-N
Purity	98%; 99% atom 13C
Solubility	Slightly soluble in Chloroform, DMSO (Heated)
Appearance	White to Off-white Solid
Storage	Store at RT under inert atmosphere