(9S)-6'-Methoxycinchonan-9-ol sulfate (2:1)

Basic Information

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CAS Number

50-54-4

Molecular Formula

C40H50N4O8S

Molecular Weight

746.93 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

212°C

SMILES

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COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.COC1=CC2=C(C=CN=C2C=C1)C(C3CC4CCN3CC4C=C)O.OS(=O)(=O)O

InChI

InChI=1S/2C20H24N2O2.H2O4S/c2*1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;1-5(2,3)4/h2*3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H2,1,2,3,4)/t2*13-,14-,19+,20-;/m00./s1

InChIKey

RONWGALEIBILOG-VCSAERELSA-N

LogP

5.693600000000005

Topological Polar Surface Area

165.78 Å²

Hydrogen Bond Donor/Acceptor

4 / 12

Complexity

538

Synonyms & References

English

Chinidine sulfate
Systodin
sk-Quinidine sulfate
Quinidine (Monosulfate)
QUINIDINE SULFATE (USP-RS)
Quinidine (sulfate dihydrate)
Quinidine sulfate, (2:1) (salt)
Kinichron
CINCHONAN-9-OL, 6'-METHOXY-, (9S)-, SULPHATE (2:1) (SALT), DIHYDRATE
SCHEMBL40999
W-109254
NSC 10004
6'-Methoxycinchonan-9-ol sulfate
Quinidini sulfas
EINECS 200-046-3
CHEBI:28482
Quinidine sulfate (salt)
Quinidine sulfate anhydrous
HSDB 5515
Cinchonan-9-ol, 6'-methoxy-, (9S)-, sulfate (2:1)
NUEDEXTA COMPONENT QUINIDINE SULFATE
NSC10004
Quinidex
(9S)-6'-Methoxycinchonan-9-ol sulfate
Q27251556
(9S)-6'-Methoxycinchonan-9-ol sulfate (2:1) (salt)
QUINIDINE SULFATE (2:1) (SALT), DIHYDRATE
QUINIDINE SULFATE [HSDB]
QUINIDINE SULFATE (USP MONOGRAPH)
QUINIDINE SULFATE COMPONENT OF NUEDEXTA
DTXCID301022773

MDL Number

MFCD00135926

FAQ

What are the physical and chemical properties of (9S)-6'-Methoxycinchonan-9-ol sulfate (2:1) (CAS: 50-54-4)?

(9S)-6'-Methoxycinchonan-9-ol sulfate (2:1) (CAS: 50-54-4) is a crystalline compound with a molecular weight of approximately 325.36 g/mol. It is slightly soluble in water and soluble in ethanol. This compound is known for its reactivity with various metal ions and exhibits good stability under normal conditions. It is also known for its antimalarial and antifungal activities.

How is (9S)-6'-Methoxycinchonan-9-ol sulfate (2:1) (CAS: 50-54-4) typically synthesized?

(9S)-6'-Methoxycinchonan-9-ol sulfate (2:1) (CAS: 50-54-4) is typically synthesized through the methylation of cinchonan-9-ol followed by sulfate esterification. The reaction proceeds with high selectivity and good yield, often utilizing sulfuric acid as the catalyst. The process is performed in a controlled environment to ensure the desired product is obtained.

What industries use (9S)-6'-Methoxycinchonan-9-ol sulfate (2:1) (CAS: 50-54-4)?

(9S)-6'-Methoxycinchonan-9-ol sulfate (2:1) (CAS: 50-54-4) is primarily used in the pharmaceutical industry for its antimalarial and antifungal properties. It is also explored in the development of new drug candidates and as a reagent in synthetic chemistry. Additionally, it has potential applications in the formulation of topical antifungal creams and in the production of certain natural product derivatives.

What precautions should be taken when handling (9S)-6'-Methoxycinchonan-9-ol sulfate (2:1) (CAS: 50-54-4)?

When handling (9S)-6'-Methoxycinchonan-9-ol sulfate (2:1) (CAS: 50-54-4), it is essential to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. This compound should be handled in a well-ventilated area or under a fume hood to minimize exposure. In case of a spill, it should be cleaned up immediately using appropriate absorbent materials. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.