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Salicylic Acid-[13C6]

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General Information
Catalog: BLP-012110
CAS: 1189678-81-6
Molecular Formula: C[13C]6H6O3
Molecular Weight: 144.08

Chemical Structure

Description	Salicylic Acid-[13C6] is a labelled analogue of Salicylic acid. Salicylic acid is a natural product extracted from Willow bark, well known as an antiinflammatory inhibitor of cyclooxygenase activity. Salicylic acid is widely used in organic synthesis and functions as a plant hormone and is known for its ability to ease aches and pains and reduce fevers.
Synonyms	Salicylic Acid 13C6; 2-Hydroxy(13C6)benzoic acid; [U-ring-13C6]-Hydroxybenzoic acid
IUPAC Name	6-hydroxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carboxylic acid
Related CAS	69-72-7 (unlabelled)
Isomeric SMILES	[13CH]1=[13CH][13CH]=[13C]([13C](=[13CH]1)C(=O)O)O
Canonical SMILES	C1=CC=C(C(=C1)C(=O)O)O
InChI	InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)/i1+1,2+1,3+1,4+1,5+1,6+1
InChI Key	YGSDEFSMJLZEOE-IDEBNGHGSA-N
Melting Point	156-159°C
Purity	95% atom 13C
Density	1.4±0.1 g/cm3
Solubility	Soluble in DMSO, Methanol
Appearance	Off-white to Pale Beige Solid
Application	Labelled acetylsalicylic acid impurity B.
Storage	Store at -20°C