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3-Methyl-2-buten-1-ol-[d6]

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General Information
Catalog: BLP-010485
CAS: 53439-16-0
Molecular Formula: C5H4D6O
Molecular Weight: 92.17

Chemical Structure

Synonyms	3-Methyl-2-buten-1-ol-d6; 2-Methyl-2-buten-4-ol-d6; 3,3-Dimethylallyl Alcohol-d6; 3-Methylcrotyl Alcohol-d6; NSC 158709-d6; Prenol-d6
IUPAC Name	4,4,4-trideuterio-3-(trideuteriomethyl)but-2-en-1-ol
Related CAS	556-82-1 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C(=CCO)C([2H])([2H])[2H]
Canonical SMILES	CC(=CCO)C
InChI	InChI=1S/C5H10O/c1-5(2)3-4-6/h3,6H,4H2,1-2H3/i1D3,2D3
InChI Key	ASUAYTHWZCLXAN-WFGJKAKNSA-N
Purity	95%
Solubility	Slightly soluble in Chloroform, Methanol
Appearance	Clear Colorless to Pale Yellow Oily Matter
Application	Important compounds in coffee aroma.
Storage	Store at 2-8°C