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Mabuterol-[d9]

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General Information
Catalog: BLP-006849
CAS: 1246819-58-8
Molecular Formula: C13H9D9ClF3N2O
Molecular Weight: 319.80

Chemical Structure

Description	Mabuterol-[d9] is a labelled analog of Mabuterol, which is a selective β2 adrenoreceptor agonist.
Synonyms	Ambuterol-d9
IUPAC Name	1-[4-amino-3-chloro-5-(trifluoromethyl)phenyl]-2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]ethanol
Related CAS	56341-08-3 (unlabelled) 1353867-83-0 (Hydrochloride)
Isomeric SMILES	[2H]C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])NCC(C1=CC(=C(C(=C1)Cl)N)C(F)(F)F)O
Canonical SMILES	CC(C)(C)NCC(C1=CC(=C(C(=C1)Cl)N)C(F)(F)F)O
InChI	InChI=1S/C13H18ClF3N2O/c1-12(2,3)19-6-10(20)7-4-8(13(15,16)17)11(18)9(14)5-7/h4-5,10,19-20H,6,18H2,1-3H3/i1D3,2D3,3D3
InChI Key	JSJCTEKTBOKRST-GQALSZNTSA-N
Boiling Point	375.9±37.0°C at 760 mmHg
Melting Point	92-96°C
Purity	98% by CP; 98% atom D
Density	1.3±0.1 g/cm3
Solubility	Soluble in Chloroform, Methanol
Appearance	Pale Yellow to Pale Orange Solid
Storage	Store at -20°C