Desogestrel

CAS 54024-22-5C22H30OMW 310.5

Desogestrel (CAS 54024-22-5) — formula C22H30O, molecular weight 310.5.

Product Overview

CAS Number	54024-22-5
Molecular Formula	C22H30O
Molecular Weight	310.5
Melting Point	109-110ºC
Boiling Point	428ºC
LogP	5.65
Applications	Uses: MEDICATION, Use (kg, approx.) in Germany (2009): >25, Use (kg) in USA (2002): 14, Consumption (g per capita, approx.) in Germany (2009): 0.000305, Consumption (g per capita) in the USA (2002): 5.03e-05, Calculated removal (%): 95.8, Methods of Manufacturing:, Desogestrel, is produced by adding a solution of 11, 11-methylene-18-methyl-delta4-estren-17-one in tetrahydrofuran to potassium acetylide solution in tetrahydrofuran and acidified., Impurities: Reported impurities include: 13-ethyl-16-[13-ethyl-17beta-hydroxy-11-methylene-18, 19-dinor-17alpha-pregn-4-en-20-yn-16-ylidene]-11-methylene-18, 19-dinor-17alpha-pregn-4-en-20-yn-17beta-ol, 13-ethyl-11-methylene-18, 19-dinor-5alpha, 17alpha-pregn-3-en-20-yn-17-ol (desogestrel D3-isomer) and 11-methylene-19-nor-17alpha-pregn-4-en-20-yn-17-ol, 13-ethyl-11-methylenegon-4-en-17-one., Formulations, Preparations: Oral: Tablets: 0.15 mg, 0.03 mg (desogestrel and ethinyl estradiol), Apri (Barr Laboratories Inc)., Desogestrel is available commercially only in combination with ethinylestradiol in tablets., Oral: Tablet (film coated): 75 ug Cerazette (Organon Laboratories Limited)., General Manufacturing Information: ...manufactured or formulated in Argentina, Australia, Belgium, Brazil, Canada, France, Germany, India, Mexico, the Netherlands, South Africa, Spain, Switzerland, the United Kingdom, and the United States.

Applications

Documented applications: Uses: MEDICATION, Use (kg, approx.) in Germany (2009): >25, Use (kg) in USA (2002): 14, Consumption (g per capita, approx.) in Germany (2009): 0.000305, Consumption (g per capita) in the USA (2002): 5.03e-05, Calculated removal (%): 95.8, Methods of Manufacturing:, Desogestrel, is produced by adding a solution of 11, 11-methylene-18-methyl-delta4-estren-17-one in tetrahydrofuran to potassium acetylide solution in tetrahydrofuran and acidified., Impurities: Reported impurities include: 13-ethyl-16-[13-ethyl-17beta-hydroxy-11-methylene-18, 19-dinor-17alpha-pregn-4-en-20-yn-16-ylidene]-11-methylene-18, 19-dinor-17alpha-pregn-4-en-20-yn-17beta-ol, 13-ethyl-11-methylene-18, 19-dinor-5alpha, 17alpha-pregn-3-en-20-yn-17-ol (desogestrel D3-isomer) and 11-methylene-19-nor-17alpha-pregn-4-en-20-yn-17-ol, 13-ethyl-11-methylenegon-4-en-17-one., Formulations, Preparations: Oral: Tablets: 0.15 mg, 0.03 mg (desogestrel and ethinyl estradiol), Apri (Barr Laboratories Inc)., Desogestrel is available commercially only in combination with ethinylestradiol in tablets., Oral: Tablet (film coated): 75 ug Cerazette (Organon Laboratories Limited)., General Manufacturing Information: ...manufactured or formulated in Argentina, Australia, Belgium, Brazil, Canada, France, Germany, India, Mexico, the Netherlands, South Africa, Spain, Switzerland, the United Kingdom, and the United States..

Technical Profile

What this product is

Desogestrel is a chemical compound with CAS registry number 54024-22-5 and molecular formula C22H30O (molecular weight 310.5).

Identification

CAS number: 54024-22-5

Its molecular formula C22H30O comprises 22 C, 30 H, 1 O atoms.

Also known as: Desogestrel · 去氧孕烯

Frequently Asked Questions

What is the CAS number of Desogestrel?

The CAS registry number of Desogestrel is 54024-22-5.

What is the molecular formula and molecular weight of Desogestrel?

Molecular formula C22H30O, molecular weight 310.5.

What other names is Desogestrel known by?

It is also registered under: Desogestrel, 去氧孕烯.

What are the documented applications of Desogestrel?

Recorded applications: Uses: MEDICATION, Use (kg, approx.) in Germany (2009): >25, Use (kg) in USA (2002): 14, Consumption (g per capita, approx.) in Germany (2009): 0.000305, Consumption (g per capita) in the USA (2002): 5.03e-05, Calculated removal (%): 95.8, Methods of Manufacturing:, Desogestrel, is produced by adding a solution of 11, 11-methylene-18-methyl-delta4-estren-17-one in tetrahydrofuran to potassium acetylide solution in tetrahydrofuran and acidified., Impurities: Reported impurities include: 13-ethyl-16-[13-ethyl-17beta-hydroxy-11-methylene-18, 19-dinor-17alpha-pregn-4-en-20-yn-16-ylidene]-11-methylene-18, 19-dinor-17alpha-pregn-4-en-20-yn-17beta-ol, 13-ethyl-11-methylene-18, 19-dinor-5alpha, 17alpha-pregn-3-en-20-yn-17-ol (desogestrel D3-isomer) and 11-methylene-19-nor-17alpha-pregn-4-en-20-yn-17-ol, 13-ethyl-11-methylenegon-4-en-17-one., Formulations, Preparations: Oral: Tablets: 0.15 mg, 0.03 mg (desogestrel and ethinyl estradiol), Apri (Barr Laboratories Inc)., Desogestrel is available commercially only in combination with ethinylestradiol in tablets., Oral: Tablet (film coated): 75 ug Cerazette (Organon Laboratories Limited)., General Manufacturing Information: ...manufactured or formulated in Argentina, Australia, Belgium, Brazil, Canada, France, Germany, India, Mexico, the Netherlands, South Africa, Spain, Switzerland, the United Kingdom, and the United States..

PubChem Public Data

Independent reference data for Desogestrel (CAS 54024-22-5), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number	54024-22-5
PubChem CID	40973
Molecular formula	C22H30O
IUPAC name	(8S,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-11-methylidene-1,2,3,6,7,8,9,10,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
UNII (FDA)	81K9V7M3A3

Computed descriptors

Molecular Weight	310.5
XLogP3	4.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	310.229665576
Monoisotopic Mass	310.229665576
Topological Polar Surface Area	20.2
Heavy Atom Count	23

Physicochemical values on record

Boiling Point	428ºC
Melting Point	109-110ºC
Melting Point	109-110 °C
Melting Point	109.5 °C
Solubility	<1 mg/ml
Solubility	3.01e-03 g/L
LogP	5.65
Dissociation Constants	13.04

Documented uses on record

Synonyms and trade names

DESOGESTREL; 54024-22-5; Cerazette; Desogestrelum; Org-2969; ORG 2969; 13-Ethyl-11-methylene-18,19-dinor-17alpha-pregn-4-en-20-yn-17-ol; DTXSID6022898; 81K9V7M3A3; CHEBI:4453; DTXCID702898; VOLNEA COMPONENT DESOGESTREL; BEKYREE COMPONENT DESOGESTREL; ENSKYCE COMPONENT DESOGESTREL; PIMTREA COMPONENT DESOGESTREL; VIORELE COMPONENT DESOGESTREL

GHS hazard classification

Reported hazard statements	H360 (10.8%), H372 (27.7%), H400 (60%), H410 (89.2%)

H360 (10.8%): May damage fertility or the unborn child [Danger Reproductive toxicity]

H360Fd (26.2%): May damage fertility; Suspected of damaging the unborn child [Danger Reproductive toxicity]

What the public record says

Desogestrel · CAS 54024-22-5 · C22H30O. UNII 81K9V7M3A3. Boiling Point: 428ºC; Melting Point: 109-110ºC; Melting Point: 109-110 °C.

Physical description and handling notes

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