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Guaifenesin-[d3]

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General Information
Catalog: BLP-012377
CAS: 1189924-85-3
Molecular Formula: C10H11D3O4
Molecular Weight: 201.23

Chemical Structure

Description	Guaifenesin-[d3] is the labelled analogue of Guaifenesin. Guaifenesin is a medication used to alleviate symptoms of cough and congestion.
Synonyms	Guaifenesin D3; 3-(o-Methoxyphenoxy)-1,2-propanediol-d3; Guaiacol Glyceryl Ether-D3; Robitussin-d3
IUPAC Name	3-[2-(trideuteriomethoxy)phenoxy]propane-1,2-diol
Related CAS	93-14-1 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])OC1=CC=CC=C1OCC(CO)O
Canonical SMILES	COC1=CC=CC=C1OCC(CO)O
InChI	InChI=1S/C10H14O4/c1-13-9-4-2-3-5-10(9)14-7-8(12)6-11/h2-5,8,11-12H,6-7H2,1H3/i1D3
InChI Key	HSRJKNPTNIJEKV-FIBGUPNXSA-N
Boiling Point	356.8±27.0 °C at 760 mmHg
Melting Point	81-83°C
Purity	95% by HPLC; 95% atom D
Density	1.2±0.1 g/cm3
Solubility	Soluble in Chloroform, Methanol
Appearance	White Solid
Storage	Store at -20°C, Under inert atmosphere