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171596-42-2

171596-42-2 Structure

171596-42-2 Structure
IdentificationBack Directory
[Name]

(1S,3R)-Methyl-1,2,3,4-tetrahydro-1-(3,4-Methylenedioxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxylate
[CAS]

171596-42-2
[Synonyms]

Tadalafil-016-1S3R
Tadalafil Impuirty Ⅵ
Tadanafil impurities 7
Tadalafil Related Impuirty 7
Tadalafil Impurity 5 Monomer
Tadalafil intermediate I diastereomer 1
(1S,3R)-Methyl-1,2,3,4-tetrahydro-1-(3,4-Methylenedioxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxylate
(1S,3R)-1-(1,3-Benzodioxol-5-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic Acid Methyl Ester
1H-Pyrido[3,4-b]indole-3-carboxylic acid, 1-(1,3-benzodioxol-5-yl)-2,3,4,9-tetrahydro-, methyl ester, (1S,3R)-
Tadalafil impurity 18/Methyl (1S,3R)-1-(1,3-benzodioxol-5-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate
[Molecular Formula]

C20H18N2O4
[MDL Number]

MFCD09842281
[MOL File]

171596-42-2.mol
[Molecular Weight]

350.37
Chemical PropertiesBack Directory
[Melting point ]

83-85°C
[Boiling point ]

531.0±50.0 °C(Predicted)
[density ]

1.359±0.06 g/cm3(Predicted)
[storage temp. ]

Refrigerator
[solubility ]

Acetone (Slightly), Chloroform (Slightly), Ethyl Acetate (Slightly)
[form ]

Solid
[pka]

16.87±0.60(Predicted)
[color ]

White to Yellow
Hazard InformationBack Directory
[Chemical Properties]

Light Yellow Powder
[Uses]

(1S,3R)-Methyl-1,2,3,4-tetrahydro-1-(3,4-Methylenedioxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxylate can be used as an intermediate in the synthesis of Tadafil, which is used for the treatment of erectile dysfunction.
[Uses]

An intermediate in the synthesis of thephosphodiesterase 5 inhibitor Tadalafil (T004500).
Spectrum DetailBack Directory
[Spectrum Detail]

(1S,3R)-Methyl-1,2,3,4-tetrahydro-1-(3,4-Methylenedioxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxylate(171596-42-2)1HNMR
(1S,3R)-Methyl-1,2,3,4-tetrahydro-1-(3,4-Methylenedioxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxylate(171596-42-2)13CNMR
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