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3,6-Dichloro-2-hydroxybenzoic acid-(phenyl-[13C6])

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General Information
Catalog: BLP-005721
CAS: 1173019-34-5
Molecular Formula: [13C]6CH4Cl2O3
Molecular Weight: 212.97

Chemical Structure

Description	3,6-Dichloro-2-hydroxybenzoic acid-(phenyl-[13C6]) is an isotope analogue of 3,6-Dichloro-2-hydroxybenzoic acid. 3,6-Dichloro-2-hydroxybenzoic acid can be used as intermediate for synthesis of active chemicals.
Synonyms	3,6-Dichlorosalicylic acid-(ring-13C6)
IUPAC Name	2,5-dichloro-6-hydroxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carboxylic acid
Related CAS	3401-80-7 (unlabelled)
Isomeric SMILES	[13CH]1=[13CH][13C](=[13C]([13C](=[13C]1Cl)C(=O)O)O)Cl
Canonical SMILES	C1=CC(=C(C(=C1Cl)C(=O)O)O)Cl
InChI	InChI=1S/C7H4Cl2O3/c8-3-1-2-4(9)6(10)5(3)7(11)12/h1-2,10H,(H,11,12)/i1+1,2+1,3+1,4+1,5+1,6+1
InChI Key	FKIKPQHMWFZFEB-IDEBNGHGSA-N
Purity	98% by CP; 99% atom 13C
Appearance	Solid
Storage	Store at -20°C