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2,4,6-Trichlorophenol-[3,5-d2]

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General Information
Catalog: BLP-010323
CAS: 93951-80-5
Molecular Formula: C6HD2Cl3O
Molecular Weight: 199.46

Chemical Structure

Synonyms	2,4,6-trichlorophenol (ring-d2)
IUPAC Name	2,4,6-trichloro-3,5-dideuteriophenol
Related CAS	88-06-2 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1Cl)O)Cl)[2H])Cl
Canonical SMILES	C1=C(C=C(C(=C1Cl)O)Cl)Cl
InChI	InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H/i1D,2D
InChI Key	LINPIYWFGCPVIE-QDNHWIQGSA-N
Boiling Point	246°C (lit.)
Melting Point	64-66°C (lit.)
Purity	98 atom % D
Density	1.612 g/cm3
Solubility	Soluble in Chloroform (Sparingly), Methanol (Slightly)
Appearance	White to Off-white Solid
Storage	Store at -20°C