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Isotope Labeled Active Pharmaceutical Ingredients (APIs)
rac Guaifenesin-[d5]

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rac Guaifenesin-[d5]

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General Information
Catalog: BLP-012552
CAS: 1329563-41-8
Molecular Formula: C10H9D5O4
Molecular Weight: 203.25

Chemical Structure

Description	rac Guaifenesin-[d5] is the labelled analogue of Guaifenesin. Guaifenesin is a medication used to alleviate symptoms of cough and congestion.
Synonyms	rac Guaifenesin D5; 3-(o-Methoxyphenoxy)-1,2-propanediol-d5; Guaiacol Glyceryl-d5 Ether; Robitussin-d5
IUPAC Name	1,1,2,3,3-pentadeuterio-3-(2-methoxyphenoxy)propane-1,2-diol
Related CAS	93-14-1 (unlabelled)
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/i6D2,7D2,8D
InChI Key	HSRJKNPTNIJEKV-RORPNYJOSA-N
Boiling Point	356.8±27.0 °C at 760 mmHg
Melting Point	76-81°C
Purity	95% by HPLC; 95% atom D
Density	1.2±0.1 g/cm3
Solubility	Soluble in Chloroform, Ethanol, Methanol
Appearance	White to Off-white Solid
Storage	Store at -20°C