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Application Area
Environmental
Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Clinical diagnostic
Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry
Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research
Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

Celiprolol-[d9] Hydrochloride

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General Information
Catalog: BLP-013948
CAS: 1215535-20-8
Molecular Formula: C20H25D9ClN3O4
Molecular Weight: 425.01
Chemical Structure
Celiprolol-[d9] Hydrochloride
Description Celiprolol-[d9] Hydrochloride is a labelled form of Celiprolol Hydrochloride. Celiprolol hydrochloride is a cardioselective β1-adrenergic blocker with potential antianginal and antihypertensive properties.
Synonyms N'-[3-Acetyl-4-[3-[(1,1-dimethylethyl-d9)amino]-2-hydroxypropoxy]phenyl]-N,N-diethylurea Hydrochloride; Celectol-d9; Corliprol-d9; NSC 324509-d9; REV 5320A-d9; ST 1396-d9
IUPAC Name 3-[3-acetyl-4-[3-[[1,1,1,3,3,3-hexadeuterio-2-(trideuteriomethyl)propan-2-yl]amino]-2-hydroxypropoxy]phenyl]-1,1-diethylurea;hydrochloride
Related CAS 57470-78-7 (unlabelled) 1215898-38-6 (free base)
Isomeric SMILES [2H]C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])NCC(COC1=C(C=C(C=C1)NC(=O)N(CC)CC)C(=O)C)O.Cl
Canonical SMILES CCN(CC)C(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C(=O)C.Cl
InChI InChI=1S/C20H33N3O4.ClH/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6;/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26);1H/i4D3,5D3,6D3;
InChI Key VKJHTUVLJYWAEY-SBYXYGIXSA-N
Melting Point 188-191°C
Purity 95%
Solubility Soluble in Methanol (Slightly), Water (Slightly)
Appearance Off-White Solid
Application Labelled Celiprolol. Cardioselective β1-adrenergic blocker. Antihypertensive, antianginal.
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