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1-Hexan-[d13]-ol

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General Information
Catalog: BLP-009378
CAS: 204244-84-8
Molecular Formula: C6HD13O
Molecular Weight: 115.25

Chemical Structure

Description	1-Hexan-[d13]-ol is a deuterated version of 1-Hexanol, a linear primary alcohol. 1-Hexanol is produced from coconut oil and palm oils. It is used in the production of antiseptics, fragrances and perfumes.
Synonyms	n-Hexyl-d13 Alcohol
IUPAC Name	1,1,2,2,3,3,4,4,5,5,6,6,6-tridecadeuteriohexan-1-ol
Related CAS	111-27-3 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])O
Canonical SMILES	CCCCCCO
InChI	InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3/i1D3,2D2,3D2,4D2,5D2,6D2
InChI Key	ZSIAUFGUXNUGDI-UTBWLCBWSA-N
Boiling Point	156.5°C (lit.)
Melting Point	−52°C (lit.)
Purity	≥99% by CP; ≥98% atom D
Density	0.918 g/cm3
Storage	Store at RT