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1,4-Butanediol-[2,2,3,3-d4]

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General Information
Catalog: BLP-009156
CAS: 38274-25-8
Molecular Formula: C4H6D4O2
Molecular Weight: 94.15

Chemical Structure

Description	Labelled 1,4-Butanediol. 1,4-Butanediol is used industrially as a solvent and in the manufacture of some types of plastics, elastic fibers and polyurethanes. 1,4-butanediol is used for the synthesis of γ-butyrolactone (GBL). In the presence of phosphoric acid and high temperature, it dehydrates to the important solvent tetrahydrofuran.
Synonyms	1,4-Butane-2,2,3,3-D4-Diol
IUPAC Name	2,2,3,3-tetradeuteriobutane-1,4-diol
Related CAS	110-63-4 (unlabelled)
Isomeric SMILES	[2H]C([2H])(CO)C([2H])([2H])CO
Canonical SMILES	C(CCO)CO
InChI	InChI=1S/C4H10O2/c5-3-1-2-4-6/h5-6H,1-4H2/i1D2,2D2
InChI Key	WERYXYBDKMZEQL-LNLMKGTHSA-N
Boiling Point	230°C (lit.)
Melting Point	16°C (lit.)
Purity	99% by CP; 98% atom D
Density	1.062 g/cm3