ChemicalBook--->CAS DataBase List--->835654-68-7

835654-68-7

835654-68-7 Structure

835654-68-7 Structure
IdentificationBack Directory
[Name]

Rotigotine Impurity 19 (Rotigotine EP Impurity F)
[CAS]

835654-68-7
[Synonyms]

Rotigotine Impurity 18
5-methyloxadiazole-4-carboxylic acid
Rotigotine Impurity 19 (Rotigotine EP Impurity F)
1-Naphthalenol, 5,6,7,8-tetrahydro-6-[propyl[2-(2-thienyl)ethyl]amino]-, 1-acetate, (6S)-
1-Naphthalenol, 5,6,7,8-tetrahydro-6-[propyl[2-(2-thienyl)ethyl]amino]-,acetate (ester), (6S)-
Acetyl RotigotineQ: What is Acetyl Rotigotine Q: What is the CAS Number of Acetyl Rotigotine
[Molecular Formula]

C21H27NO2S
[MOL File]

835654-68-7.mol
[Molecular Weight]

357.51
Chemical PropertiesBack Directory
[Boiling point ]

498.3±45.0 °C(Predicted)
[density ]

1.15±0.1 g/cm3(Predicted)
[pka]

8.76±0.20(Predicted)
[InChI]

InChI=1S/C21H27NO2S/c1-3-12-22(13-11-19-7-5-14-25-19)18-9-10-20-17(15-18)6-4-8-21(20)24-16(2)23/h4-8,14,18H,3,9-13,15H2,1-2H3/t18-/m0/s1
[InChIKey]

DSYJRJFDFYEVFD-SFHVURJKSA-N
[SMILES]

C1(OC(=O)C)=C2C(C[C@@H](N(CCC)CCC3SC=CC=3)CC2)=CC=C1
Hazard InformationBack Directory
[Uses]

O-Acetylrotigotine is an impurity of Rotigotine , which is a non-??ergolinic dopamine agonist used in the treatment of Parkinson's disorder and restless legs syndrome.
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