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Celiprolol

CAS 56980-93-9C20H33N3O4MW 379.5

Celiprolol (CAS 56980-93-9) — formula C20H33N3O4, molecular weight 379.5.

Product Overview

CAS Number56980-93-9
Molecular FormulaC20H33N3O4
Molecular Weight379.5
Melting Point120-122
LogP1.92
ApplicationsUses: Use (kg, approx.) in Germany (2009): >2500, Consumption (g per capita, approx.) in Germany (2009): 0.0305, Excretion rate: 0.95, Calculated removal (%): 22.7, Use Classification: Pharmaceuticals

Applications

Documented applications: Uses: Use (kg, approx.) in Germany (2009): >2500, Consumption (g per capita, approx.) in Germany (2009): 0.0305, Excretion rate: 0.95, Calculated removal (%): 22.7, Use Classification: Pharmaceuticals.

Technical Profile

What this product is

Celiprolol is a chemical compound with CAS registry number 56980-93-9 and molecular formula C20H33N3O4 (molecular weight 379.5).

Identification

CAS number: 56980-93-9

Its molecular formula C20H33N3O4 comprises 20 C, 33 H, 3 N, 4 O atoms.

Also known as: Celiprolol · 塞利洛尔

Frequently Asked Questions

What is the CAS number of Celiprolol?

The CAS registry number of Celiprolol is 56980-93-9.

What is the molecular formula and molecular weight of Celiprolol?

Molecular formula C20H33N3O4, molecular weight 379.5.

What other names is Celiprolol known by?

It is also registered under: Celiprolol, 塞利洛尔.

What are the documented applications of Celiprolol?

Recorded applications: Uses: Use (kg, approx.) in Germany (2009): >2500, Consumption (g per capita, approx.) in Germany (2009): 0.0305, Excretion rate: 0.95, Calculated removal (%): 22.7, Use Classification: Pharmaceuticals.

PubChem Public Data

Independent reference data for Celiprolol (CAS 56980-93-9), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number56980-93-9
PubChem CID2663
Molecular formulaC20H33N3O4
IUPAC name3-[3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,1-diethylurea
UNII (FDA)DRB57K47QC

Computed descriptors

Molecular Weight379.5
XLogP31.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass379.24710654
Monoisotopic Mass379.24710654
Topological Polar Surface Area90.9
Heavy Atom Count27

Physicochemical values on record

Melting Point120-122
LogP1.92
Dissociation Constants9.66

Documented uses on record

    Use (kg; approx.) in Germany (2009): >2500Consumption (g per capita; approx.) in Germany (2009): 0.0305

    Synonyms and trade names

    celiprolol; 56980-93-9; Celiprololum; Celiprolol PCH; UL/1677; RHC-5320A; ACER002 FREE BASE; DRB57K47QC; ACER-002 FREE BASE; DTXSID3020259; ST1396; N'-(3-Acetyl-4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N,N-diethylurea; Urea, N'-(3-acetyl-4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N,N-diethyl-; 1-{3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl}-3,3-diethylurea; 1-(3-acetyl-4-(3-(tert-butylamino)-2-hydroxypropoxy)phenyl)-3,3-diethylurea; RefChem:124293

    GHS hazard classification

    Reported hazard statementsH412 (100%)

    H412 (100%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

    P273, and P501 (click each P-code to see the statement)

    What the public record says

    Celiprolol · CAS 56980-93-9 · C20H33N3O4. UNII DRB57K47QC. Melting Point: 120-122; LogP: 1.92; Dissociation Constants: 9.66.

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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