1-(((8-beta)-6-Methylergolin-8-yl)methyl)-2,5-pyrrolidinedione

Base Information

• Chemical Name: 1-(((8-beta)-6-Methylergolin-8-yl)methyl)-2,5-pyrrolidinedione
• CAS No.: 105579-49-5
• Molecular Formula: C20H23 N3 O2
• Molecular Weight: 337.4155
• DSSTox Substance ID: DTXSID60909606
• Mol file: 105579-49-5.mol

Synonyms:1-(((8-beta)-6-Methylergolin-8-yl)methyl)-2,5-pyrrolidinedione;2,5-Pyrrolidinedione, 1-(((8-beta)-6-methylergolin-8-yl)methyl)-;105579-49-5;SCHEMBL10754930;DTXSID60909606;LS-137696;1-[(6-Methylergolin-8-yl)methyl]pyrrolidine-2,5-dione

Chemical Property of 1-(((8-beta)-6-Methylergolin-8-yl)methyl)-2,5-pyrrolidinedione

Chemical Property:

• Vapor Pressure: 2.02E-13mmHg at 25°C
• Boiling Point: 579.4°Cat760mmHg
• Flash Point: 304.2°C
• Density: 1.295g/cm³
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 337.17902698
• Heavy Atom Count: 25
• Complexity: 563

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CC(CC2C1CC3=CNC4=CC=CC2=C34)CN5C(=O)CCC5=O
• Isomeric SMILES: CN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CN5C(=O)CCC5=O