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trans,trans-Muconic Acid-[d4]

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General Information
Catalog: BLP-007485
CAS: 1185239-59-1
Molecular Formula: C6H2D4O4
Molecular Weight: 146.13

Chemical Structure

Description	trans,trans-Muconic Acid is a metabolite found in urine, which determines biological exposure index for workers exposed to Benzene.
Synonyms	(2E,4E)-2,4-Hexadienedioic Acid-d4; (E,E)-Muconic acid-d4; NSC 66486-d4; trans,trans-2,4-Hexadienedioic Acid-d4
IUPAC Name	(2E,4E)-2,3,4,5-tetradeuteriohexa-2,4-dienedioic acid
Related CAS	3588-17-8 (unlabelled)
Canonical SMILES	C(=CC(=O)O)C=CC(=O)O
InChI	InChI=1S/C6H6O4/c7-5(8)3-1-2-4-6(9)10/h1-4H,(H,7,8)(H,9,10)/b3-1+,4-2+/i1D,2D,3D,4D
InChI Key	TXXHDPDFNKHHGW-NFCKNUJASA-N
Melting Point	>245°C (dec.)
Solubility	Soluble in DMSO, Methanol (Sparingly)
Appearance	White to Beige Solid
Storage	Store at -20°C