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2,3-Dichlorobenzoic Acid-[13C]

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General Information
Catalog: BLP-010320
CAS: 1184971-82-1
Molecular Formula: C6[13C]H4Cl2O2
Molecular Weight: 192.00

Chemical Structure

Description	2,3-Dichlorobenzoic Acid-[13C] is the labelled key intermediate for antiepileptic drug Lamotrigine.
Synonyms	2,3-Dichloro-benzoic Acid-13C
IUPAC Name	2,3-dichlorobenzoic acid
Related CAS	50-45-3 (unlabelled)
Isomeric SMILES	C1=CC(=C(C(=C1)Cl)Cl)[13C](=O)O
Canonical SMILES	C1=CC(=C(C(=C1)Cl)Cl)C(=O)O
InChI	InChI=1S/C7H4Cl2O2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H,10,11)/i7+1
InChI Key	QAOJBHRZQQDFHA-CDYZYAPPSA-N
Melting Point	162-164°C
Purity	95%
Solubility	Soluble in DMSO, Methanol
Appearance	Brown Solid