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Benzoyl Chloride-[13C6]

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General Information
Catalog: BLP-015970
CAS: 266308-67-2
Molecular Formula: C13C6H5ClO
Molecular Weight: 146.52

Chemical Structure

Description	Benzoyl Chloride-13C6 acts a reagent for the synthesis of 13C-labeled opiates, cocaine derivatives and selected urinary metabolites.
Synonyms	α-Chlorobenzaldehyde-13C6; Benzenecarbonyl-13C6 Chloride; Benzoic Acid-13C6 Chloride; Phenylcarbonyl-13C6 Chloride;
IUPAC Name	(1,2,3,4,5,6-13C6)cyclohexatrienecarbonyl chloride
Isomeric SMILES	[13CH]1=[13CH][13CH]=[13C]([13CH]=[13CH]1)C(=O)Cl
Canonical SMILES	C1=CC=C(C=C1)C(=O)Cl
InChI	InChI=1S/C7H5ClO/c8-7(9)6-4-2-1-3-5-6/h1-5H/i1+1,2+1,3+1,4+1,5+1,6+1
InChI Key	PASDCCFISLVPSO-IDEBNGHGSA-N
Solubility	Chloroform (Slightly), Methanol (Slightly)
Appearance	Colourless Oil
Storage	4°C, Hygroscopic