Drospirenone

Iupac Name：(1R,2R,4R,10R,11S,14S,15S,16S,18S,19S)-10,14-dimethylspiro[hexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadec-5-ene-15,5'-oxolane]-2',7-dione

CAS No.: 67392-87-4

Molecular Weight：366.4932

Modify Date.: 2022-11-10 14:53

Introduction: Synthetic progestogen exhibiting antimineralocorticoid and antiandrogenic activity. View more+

Request For Quotation

1. Names and Identifiers

1.1 Name: Drospirenone
1.2 Synonyms: (2′S,6R,7R,8R,9S,10R,13S,14S,15S,16S)-1,3′,4′,6,7,8,9,10,11,12,13,14,15,16,20,21-Hexadecahydro-10,13-dimethylspiro[17H-dicyclopropa[6,7:15,16]cyclopenta[a]phenanthrene-17,2′(5′H)-furan]-3,5′(2H)-dione 1,2-Dihydrospirorenone 17β-Hydroxy-6β,7β:15β,16β-dimethylene-3-oxo-17α-pregn-4-ene-21-carboxylic acid γ-lactone 3-Oxo-6β,7β:15β,16β-dimethylene-17α-pregn-4-en-21,17-carbolactone 6b,7b:15b,16b-Dimethylen-3-oxo-17a-pregn-4-ene-21 6β,7β:15β,16β-Dimethylene-3-oxo-17α-pregn-4-ene-21,17-carbolactone BRN 4765500 CCRIS 6523 Dihydrospirorenone Drospirenona Drospirenone (USP32) Drospirenone(Dihydrospirorenone) Drosporenone Spiro[17H-dicyclopropa[6,7:15,16]cyclopenta[a]phenanthrene-17,2'(5'H)-furan]-3,5'(2H)-dione Spiro[17H-dicyclopropa[6,7:15,16]cyclopenta[a]phenanthrene-17,2′(5′H)-furan]-3,5′(2H)-dione, 1,3′,4′,6,7,8,9,10,11,12,13,14,15,16,20,21-hexadecahydro-10,13-dimethyl-, (2′S,6R,7R,8R,9S,10R,13S,14S,15S,16S)- Spiro[17H-dicyclopropa[6,7:15,16]cyclopenta[a]phenanthrene-17,2′(5′H)-furan]-3,5′(2H)-dione, 1,3′,4′,6,7,8,9,10,11,12,13,14,15,16,20,21-hexadecahydro-10,13-dimethyl-, [6R-(6α,7α,8β,9α,10β,13β,14α,15α,16α,17β)]- ZK 30595

1.3 CAS No.: 67392-87-4

1.4 CID: 68873

1.5 EINECS(EC#): 266-679-2

1.6 Molecular Formula: C24H30O3 (isomer)

1.7 Inchi: InChI=1S/C24H30O3/c1-22-6-3-12(25)9-17(22)13-10-14(13)20-16(22)4-7-23(2)21(20)15-11-18(15)24(23)8-5-19(26)27-24/h9,13-16,18,20-21H,3-8,10-11H2,1-2H3/t13-,14+,15-,16+,18+,20-,21+,22-,23+,24+/m1/s1

1.8 InChkey: METQSPRSQINEEU-HXCATZOESA-N

1.9 Canonical Smiles: CC12CCC(=O)C=C1C3CC3C4C2CCC5(C4C6CC6C57CCC(=O)O7)C

1.10 Isomers Smiles: C[C@]12CCC(=O)C=C1[C@@H]3C[C@@H]3[C@@H]4[C@@H]2CC[C@]5([C@H]4[C@@H]6C[C@@H]6[C@@]57CCC(=O)O7)C

2. Properties

2.1 Density: 1.26

2.1 Melting point: 196-200℃

2.1 Boiling point: 552.2 oC at 760 mmHg

2.1 Refractive index: 1.61

2.1 Flash Point: 241.6 oC

2.1 Precise Quality: 366.21900

2.1 PSA: 43.37000

2.1 logP: 4.30590

2.1 Solubility: In water, 1.81 mg/L at 25 °C (est)

2.2 Λmax: 265(MeOH)nm

2.3 Appearance: white to off-white crystalline powder

2.4 Chemical Properties: Off-White Crystalline Powder

2.5 Color/Form: Powder

2.6 pKa: [-5]

2.7 Water Solubility: In water, 1.81 mg/L at 25 °C (est)

2.8 StorageTemp: 0-10°C

3. Use and Manufacturing

3.1 Usage: Synthetic progestogen exhibiting antimineralocorticoid and antiandrogenic activity.

4. Safety and Handling

4.1 Symbol: GHS08;

4.1 Signal Word: DANGER

4.1 Risk Statements: 60

4.1 Hazard Declaration: H360

4.1 WGK Germany: 3

4.1 RTECS: WH1299000

4.1 Specification: ? Drospirenone (CAS NO.67392-87-4), its Synonyms are 1,2-Dihydrospirorenone ; 6R,7R,8R,9S,10R,13S,14S,15S,16S,17S)-1,3',4',6,6a,7,8,9,10,11,12,13,14,15,15a,16-Hexadecahydro-10,13-dimethylspiro-(17H-dicyclopropa(6,7:15,16)cyclopenta(a)phenanthrene-17,2'(5'H)-furan)-3,5'(2H)-dione ; 17-Hydroxy-6beta,7beta:15beta,16beta-dimethylene-3-oxo-17alpha-pregn-4-ene-21-carboxylic acid, gamma-lactone ; 6-beta,7-beta;15-beta,16-beta-Dimethylene-3-oxo-17-alpha-pregn-4-ene-21,17-carbolactone ; Drospirenona . It is off-white crystalline powder.

4.2 Toxicity

CHEMICAL IDENTIFICATION

RTECS NUMBER :: WH1299000

CAS REGISTRY NUMBER :: 67392-87-4

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C24-H30-O3

MOLECULAR WEIGHT :: 366.54

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Subcutaneous

DOSE :: 1200 ug/kg

SEX/DURATION :: female 1 day(s) pre-mating

TOXIC EFFECTS :: Reproductive - Fertility - other measures of fertility

REFERENCE :: ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 35,459,1985

5. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Reproductive toxicity, Category 1B

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word	Danger
Hazard statement(s)	H360 May damage fertility or the unborn child
Precautionary statement(s)
Prevention	P201 Obtain special instructions before use. P202 Do not handle until all safety precautions have been read and understood. P280 Wear protective gloves/protective clothing/eye protection/face protection.
Response	P308+P313 IF exposed or concerned: Get medical advice/ attention.
Storage	P405 Store locked up.
Disposal	P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

View all

6. NMR Spectrum

13C NMR : Predict

1H NMR : Predict

Predict 1H proton NMR

7. Computational chemical data

Molecular Weight: 366.4932g/mol
Molecular Formula: C₂₄H₃₀O₃
Compound Is Canonicalized: True
XLogP3-AA: 3.5
Exact Mass: 366.21949481
Monoisotopic Mass: 366.21949481
Complexity: 828
Rotatable Bond Count: 0
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 3
Topological Polar Surface Area: 43.4
Heavy Atom Count: 27
Defined Atom Stereocenter Count: 10
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADceB4MAAAAAAAAAAAAAAAGDAAAaIAAAAwYMEABgAAAGDAAAAAGgAAAAAAD0SAgAACCAAABACIAqDSCAAAAAAgAAAACAEAAEgAABIAAQACAAAEgAAIAQOKyPCPgAAAAAAAAACAAAYAADAAAYAADAAAAA==

8. Recommended Suppliers

Global280SuppliersView all >>

Wuhan Xiju Biotechnology Co., Ltd. Diamond member

1YR

Products:My whatsapp:+86 13043111536 cas no.1451-82-7,79099-07-3,5449-12-7,5337-93-9,49851-31-2,288573-56-8
Tel:86-311-13043111536
Email:Rachel@wh-xiju.com

High Quality 99% Drospirenone Cas 67392-87-4

Purity:99%Packing: 200kg/bag FOB
Price: 20 USD/kg
Time: 2023/03/22

Inquire

Jilin Tely Imp & Exp Co., Ltd Diamond member

4YRS

Products:Pharmaceutical raw materials,Chemical reagent, Food aditives,Plant ExtracPharmaceutical and pesticide intermediates.
Tel:86-431-81915458
Email:cathytan@jltely.com

Drospirenone

Purity:99%Packing: 200kg/bag FOB
Price: 1 USD/gram
Time: 2023/03/22

Inquire

Hanhong Medicine Technology (Hubei) Co., Ltd. Diamond member

2YRS

Products:5413-05-8 Ethyl 2-phenylacetoacetate; 20320-59-6/5449-12-7 BMK powder; 28578-16-7 Pmk glycidate; 79099-07-3 N-BOC-4-piperidone; 49851-31-2 2-bromo-1-phenylpentan-1-one; 288573-56-8
Tel:86-27-18502707335
Email:Icey@hanhong-api.com

HANHONG CAS 67392-87-4 Drospirenone 99.99% Purity Powder

Purity:99%Packing: 200kg/bag FOB
Price: 5 USD/g
Time: 2023/03/22

Inquire

Jinlan Pharm-Drugs Technology Co., Limited Diamond member

10YRS

Products:Veterinary products,Nutrition products,Agrochemicals,Active pharmaceutical Ingredients,Custom systhesis,Contract manufacturing
Tel:86-571-85829052
Email:market@royalpharms.com

Drospirenone