(9alpha,13alpha,14alpha)-3-Methoxy-17-methylmorphinan

Basic Information

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CAS Number

125-71-3

Molecular Formula

C18H25NO

Molecular Weight

271.4 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

126 ºC

Boiling Point

394.9±42.0 ºC (760 Torr),

Flash Point

116.2±30.2 ºC,

Refractive Index

1.5740 (estimate)

SMILES

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CN1CCC23CCCCC2C1CC4=C3C=C(C=C4)OC

InChI

InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3/t15-,17+,18+/m1/s1

InChIKey

MKXZASYAUGDDCJ-NJAFHUGGSA-N

LogP

3.3834000000000026

Topological Polar Surface Area

12.47 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

370

Safety Information

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Hazard Class

Class 6.1(b) Class 6.1(b)

Synonyms & References

English

Dextromethorfan [Czech]
GTPL6953
AKOS025311415
NCGC00015333-02
Racemethorphan [as d-form]
BA 2666
Destrometerfano [DCIT]
125-71-3
delta-Methorphan
Balminil DM
Albutussin
Medicon (Salt/Mix)
Dextromethorphanum [INN-Latin]
NCGC00015333-01
SCHEMBL29949
HSDB 3056
DB00514
EINECS 204-752-2
DEXTROMETHORPHAN [WHO-DD]
Romilar (Salt/Mix)
Romilar
SPBio_002378
Delsym (dextromethorphan)
DEXTROMETHORPHAN [INN]
(+)-cis-1,3,4,9,10,10a-Hexahydro-6-methoxy-11-methyl-2H-10,4alpha-iminoethanophenanthren
DEXTROMETHORPHAN [MART.]
Soothe Comfort II Cough SyrupHerbal Mint
(9a,13a,14a)-3-Methoxy-17-methylmorphinan
3-Methoxy-17-methyl-9alpha,13alpha,14alpha-morphinan
9alpha,13alpha,14alpha-Morphinan, 3-methoxy-17-methyl-
3-Methoxy-17-methyl-9.alpha.,13.alpha.,14.alpha.-morphinan

MDL Number

MFCD00866833

FAQ

What are the physical and chemical properties of (9alpha,13alpha,14alpha)-3-Methoxy-17-methylmorphinan (CAS: 125-71-3)?

The compound (9alpha,13alpha,14alpha)-3-Methoxy-17-methylmorphinan (CAS: 125-71-3) has a crystalline form with a molecular weight of approximately 279.35 g/mol. It is slightly soluble in water but more soluble in organic solvents like ethanol and acetone. Chemically, it exhibits moderate reactivity, particularly in acidic and basic conditions. It is not highly reactive but should be handled with care.

How is (9alpha,13alpha,14alpha)-3-Methoxy-17-methylmorphinan (CAS: 125-71-3) typically synthesized?

(9alpha,13alpha,14alpha)-3-Methoxy-17-methylmorphinan (CAS: 125-71-3) is typically synthesized through a multi-step process involving the modification of morphine to introduce the methoxy and methyl groups. Commonly, this involves coupling reactions, methylation steps, and cyclization. The synthesis often uses catalysts like palladium and ligands to achieve high selectivity and yield.

What industries use (9alpha,13alpha,14alpha)-3-Methoxy-17-methylmorphinan (CAS: 125-71-3)?

(9alpha,13alpha,14alpha)-3-Methoxy-17-methylmorphinan (CAS: 125-71-3) is primarily used in the pharmaceutical industry for the development of certain pain management and anti-diarrheal medications. It may also find applications in research and development for new drug formulations, although its specific uses vary based on the purity and structure of the compound.

What precautions should be taken when handling (9alpha,13alpha,14alpha)-3-Methoxy-17-methylmorphinan (CAS: 125-71-3)?

When handling (9alpha,13alpha,14alpha)-3-Methoxy-17-methylmorphinan (CAS: 125-71-3), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a laboratory coat. Work should be conducted in a fume hood to avoid inhalation. In the event of a spill, it should be immediately cleaned up according to the Material Safety Data Sheet (MSDS). The compound should be stored in a cool, dry place, away from heat sources and incompatible materials.