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Iodobenzene-[13C6]

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General Information
Catalog: BLP-011198
CAS: 104130-35-0
Molecular Formula: [13C]6H5I
Molecular Weight: 209.96

Chemical Structure

Synonyms	Iodobenzene-13C6
IUPAC Name	iodo(1,2,3,4,5,6-13C6)cyclohexatriene
Related CAS	591-50-4 (unlabelled)
Isomeric SMILES	[13CH]1=[13CH][13CH]=[13C]([13CH]=[13CH]1)I
Canonical SMILES	C1=CC=C(C=C1)I
InChI	InChI=1S/C6H5I/c7-6-4-2-1-3-5-6/h1-5H/i1+1,2+1,3+1,4+1,5+1,6+1
InChI Key	SNHMUERNLJLMHN-IDEBNGHGSA-N
Boiling Point	188°C (lit.)
Melting Point	-29°C (lit.)
Purity	99% by CP; 99% atom 13C
Density	1.876 g/cm3 at 25°C
Application	Used for preparation of uniformly Labelled 13C polychlorobiphenyl