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Benzoic acid-[1-13C]

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General Information
Catalog: BLP-011041
CAS: 55320-26-8
Molecular Formula: C6[13C]H6O2
Molecular Weight: 123.11

Chemical Structure

Description	Benzoic acid-[1-13C] is a stable isotopic analog of Benzoic Acid. Benzoic acid is a colorless crystalline solid and a simple aromatic carboxylic acid, used as a food preservative.
Synonyms	Benzoic acid-(phenyl-1-13C); Benzoic-1-13C acid
IUPAC Name	(1-13C)cyclohexatrienecarboxylic acid
Related CAS	65-85-0 (unlabelled)
Canonical SMILES	OC(=O)[13c]1ccccc1
InChI	InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i6+1
InChI Key	WPYMKLBDIGXBTP-PTQBSOBMSA-N
Boiling Point	249°C (lit.)
Melting Point	121-125°C (lit.)
Purity	99% atom 13C