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Monomethyl fumarate-[d5]

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General Information
Catalog: BLP-012461
CAS: 1616345-45-9
Molecular Formula: C5HD5O4
Molecular Weight: 135.13

Chemical Structure

Description	Monomethyl fumarate-[d5] is labelled Monomethyl fumarate. Monomethyl Fumarate is one of the most bioactive anti-psoriatic fumaric acid ester metabolite. It is potent nicotinic acid receptor agonist.
Synonyms	Monomethyl fumarate d5; (2E)-2-Butenedioic Acid 1-Methyl Ester-d5
IUPAC Name	(E)-2,3-dideuterio-4-oxo-4-(trideuteriomethoxy)but-2-enoic acid
Related CAS	2756-87-8 (unlabelled)
Canonical SMILES	COC(=O)C=CC(=O)O
InChI	InChI=1S/C5H6O4/c1-9-5(8)3-2-4(6)7/h2-3H,1H3,(H,6,7)/b3-2+/i1D3,2D,3D
InChI Key	NKHAVTQWNUWKEO-PWYLTMEHSA-N
Boiling Point	250.0±23.0 °C at 760 mmHg
Melting Point	>135°C (Subl.)
Purity	95% by HPLC; 95% atom D
Density	1.3±0.1 g/cm3
Solubility	Soluble in DMSO, Methanol
Appearance	Off-white to Light Pink Solid
Storage	Store at -20°C