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Benzoic acid-[4-13C]

General Information
Catalog: BLP-011039
CAS: 170703-36-3
Molecular Formula: C6[13C]H6O2
Molecular Weight: 123.11
Chemical Structure
Benzoic acid-[4-13C]
Description Benzoic acid-[4-13C] 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-4-13C); Benzoic acid-4-13C
IUPAC Name (4-13C)cyclohexatrienecarboxylic acid
Related CAS 65-85-0 (unlabelled)
Isomeric SMILES C1=CC(=CC=[13CH]1)C(=O)O
Canonical SMILES C1=CC=C(C=C1)C(=O)O
InChI InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1+1
InChI Key WPYMKLBDIGXBTP-OUBTZVSYSA-N
Boiling Point 249°C (lit.)
Melting Point 121-125°C (lit.)
Purity 99% atom 13C
Storage Store at 2-8°C

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