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p-Toluene-[d7]-sulfonic acid monohydrate

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General Information
Catalog: BLP-001209
CAS: 1219795-22-8
Molecular Formula: C7H3D7O4S
Molecular Weight: 197.26

Chemical Structure

Description	P-Toluene-[d7]-sulfonic acid monohydrate is a labelled form of 4-Toluenesulfonic acid monohydrate which has been used in the synthesis.
IUPAC Name	2,3,5,6-tetradeuterio-4-(trideuteriomethyl)benzenesulfonic acid;hydrate
Related CAS	6192-52-5 (unlabelled)
Canonical SMILES	CC1=CC=C(C=C1)S(=O)(=O)O.O
InChI	InChI=1S/C7H8O3S.H2O/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);1H2/i1D3,2D,3D,4D,5D;
InChI Key	KJIFKLIQANRMOU-ANHTTWOXSA-N
Purity	98% by CP; 98% atom D