9,10-Didehydro Cabergoline

Base Information

• Chemical Name: 9,10-Didehydro Cabergoline
• CAS No.: 1380085-95-9
• Molecular Formula: C26H35N5O2
• Molecular Weight: 449.6
• Mol file: 1380085-95-9.mol

Synonyms:9,10-Didehydro Cabergoline;1380085-95-9;(6aR)-N-[3-(dimethylamino)propyl]-N-(ethylcarbamoyl)-7-prop-2-enyl-6,6a,8,9-tetrahydro-5aH-indolo[4,3-fg]quinoline-9-carboxamide

Chemical Property of 9,10-Didehydro Cabergoline

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 449.27907538
• Heavy Atom Count: 33
• Complexity: 807

Purity/Quality:

99%+ ^*data from raw suppliers

9,10-DidehydroCabergoline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCNC(=O)N(CCCN(C)C)C(=O)C1CN(C2CC3C=NC4=CC=CC(=C34)C2=C1)CC=C
• Isomeric SMILES: CCNC(=O)N(CCCN(C)C)C(=O)C1CN([C@@H]2CC3C=NC4=CC=CC(=C34)C2=C1)CC=C
• Uses: 9,10-Didehydro Cabergoline is an impurity of Cabergoline (C050000), a dopamine D2-receptor agonist.