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Toluene-[13C6]

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General Information
Catalog: BLP-015267
CAS: 287399-35-3
Molecular Formula: C13C6H8
Molecular Weight: 98.09

Chemical Structure

Description	Isotope labelled toluene (T535870) is an aromatic hydrocarbon and the mono-substituted derivative of benzene. Toluene is widely used in industry as an building block for pharmaceutical goods and as well as an organic solvent in synthetic preparations. Toluene can also be used as an octane booster in gasoline fuels in internal combustion engines and as jet fuel surrogate.
Synonyms	Methyl-benzene-13C6;
IUPAC Name	methyl(1,2,3,4,5,6-13C6)cyclohexatriene
Isomeric SMILES	C[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1
Canonical SMILES	CC1=CC=CC=C1
InChI	InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3/i2+1,3+1,4+1,5+1,6+1,7+1
InChI Key	YXFVVABEGXRONW-WBJZHHNVSA-N
Solubility	DMSO
Appearance	Colourless Liquid
Storage	Refrigerator