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1-Keto Bambuterol-[d9]

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General Information
Catalog: BLP-013804
CAS: 1794885-30-5
Molecular Formula: C18H18D9N3O5
Molecular Weight: 374.48

Chemical Structure

Description	1-Keto Bambuterol-[d9] is the labelled analogue of 1-Keto Bambuterol, which is an impurity of Bambuterol.
Synonyms	1-Keto Bambuterol-d9; N,N-Dimethylcarbamic Acid C,C'-[5-[[(1,1-Dimethylethyl-d9)amino]acetyl]-1,3-phenylene] Ester; Dimethylcarbamic Acid 5-[[(1,1-Dimethylethyl-d9)amino]acetyl]-1,3-phenylene Ester; Bis[3',5'-(N,N-dimethylcarbamoyloxi)]-2-N-tert-butylaminoacetophenone-d9
IUPAC Name	[3-(dimethylcarbamoyloxy)-5-[2-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]acetyl]phenyl] N,N-dimethylcarbamate
Related CAS	112935-94-1 (unlabelled) 2153431-91-3 (unlabelled hydrochloride)
Canonical SMILES	CC(C)(C)NCC(=O)C1=CC(=CC(=C1)OC(=O)N(C)C)OC(=O)N(C)C
InChI	InChI=1S/C18H27N3O5/c1-18(2,3)19-11-15(22)12-8-13(25-16(23)20(4)5)10-14(9-12)26-17(24)21(6)7/h8-10,19H,11H2,1-7H3/i1D3,2D3,3D3
InChI Key	TWHUHQNUVSCRPV-GQALSZNTSA-N
Purity	99% by HPLC
Solubility	Soluble in Methanol (Slightly), Water (Slightly)
Appearance	White Solid
Storage	Store at 2-8°C