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Spironolactone

CAS 52-01-7C24H32O4SMW 416.6

Spironolactone (CAS 52-01-7) — formula C24H32O4S, molecular weight 416.6; category organic chemicals.

Product Overview

CAS Number52-01-7
Molecular FormulaC24H32O4S
Molecular Weight416.6
Melting Point198-207
Boiling Point134 °C
LogP2.78
CategoryOrganic Chemicals

Technical Profile

What this product is

Spironolactone is a carbon-based organic compound with CAS registry number 52-01-7 and molecular formula C24H32O4S (molecular weight 416.6), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 52-01-7

Its molecular formula C24H32O4S comprises 24 C, 32 H, 4 O, 1 S atoms.

Also known as: Spironolactone · 螺内酯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Spironolactone?

The CAS registry number of Spironolactone is 52-01-7.

What is the molecular formula and molecular weight of Spironolactone?

Molecular formula C24H32O4S, molecular weight 416.6.

What other names is Spironolactone known by?

It is also registered under: Spironolactone, 螺内酯.

Which category does Spironolactone belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for Spironolactone (CAS 52-01-7), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number52-01-7
PubChem CID5833
Molecular formulaC24H32O4S
IUPAC nameS-[(7R,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-3,5'-dioxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-7-yl] ethanethioate
UNII (FDA)27O7W4T232

Computed descriptors

Molecular Weight416.6
XLogP32.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass416.20213067
Monoisotopic Mass416.20213067
Topological Polar Surface Area85.7
Heavy Atom Count29

Physicochemical values on record

Boiling Point134 °C
Melting Point198-207
Melting Point134-135 °C
Melting Point134.5 °C
SolubilityIn water, 22 mg/L at 25 °C
Solubility1.98e-03 g/L
LogP2.78
LogPlog Kow = 2.78
LogP3.4

Documented uses on record

    Use (kg; approx.) in Germany (2009): >7500Consumption (g per capita; approx.) in Germany (2009): 0.0916

    Synonyms and trade names

    spironolactone; 52-01-7; Aldactone; Verospirone; Spirolactone; Spiresis; Uractone; Xenalon; spironolattone; Espironolactona; Spironolactonum; Abbolactone; Diatensec; Laractone; SC 9420; SC-9420

    Regulatory listings held on file

    GHS notification summary0.6% (1 / 174)

    GHS hazard classification

    GHS notification summary0.6% (1 / 174)
    Reported hazard statementsH302 (35.6%), H312 (31%), H332 (31%), H351 (66.1%), H360 (52.9%), H373 (25.3%)

    This chemical does not meet GHS hazard criteria for 0.6% (1 of 174) of reports.

    H302 (35.6%): Harmful if swallowed [Warning Acute toxicity, oral]

    What the public record says

    Spironolactone · CAS 52-01-7 · C24H32O4S. UNII 27O7W4T232. Boiling Point: 134 °C; Melting Point: 198-207; Melting Point: 134-135 °C.

    Physical description and handling notes

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

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