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1-Bromo-4-fluorobenzene-[13C6]

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General Information
Catalog: BLP-005600
CAS: 1313734-60-9
Molecular Formula: [13C]6H4BrF
Molecular Weight: 180.95

Chemical Structure

Description	1-Bromo-4-fluorobenzene-[13C6] is intended for use as an internal standard for 1-Bromo-4-fluorobenzene. 1-Bromo-4-fluorobenzene-[13C6] is a dihalogenated benzene used in the preparation of labelled pharmaceutical compounds such as atypical antipsychotic agents.
Synonyms	1-bromo-4-fluoro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene
IUPAC Name	1-bromo-4-fluorobenzene
Related CAS	460-00-4 (unlabelled)
Canonical SMILES	C1=CC(=CC=C1F)Br
InChI	InChI=1S/C6H4BrF/c7-5-1-3-6(8)4-2-5/h1-4H/i1+1,2+1,3+1,4+1,5+1,6+1
InChI Key	AITNMTXHTIIIBB-IDEBNGHGSA-N
Boiling Point	150°C
Melting Point	-16°C
Purity	98% by CP; 99% atom 13C
Density	1.647 g/mL at 25°C
Appearance	Clear, colorless liquid