Ergoline-8-beta-carboxamide, N-benzyloxy-9,10-didehydro-6-methyl-

Base Information

• Chemical Name: Ergoline-8-beta-carboxamide, N-benzyloxy-9,10-didehydro-6-methyl-
• CAS No.: 63938-25-0
• Molecular Formula: C23H23 N3 O2
• Molecular Weight: 373.4476
• DSSTox Substance ID: DTXSID10213765
• Nikkaji Number: J59.190D
• Wikidata: Q76152576
• Mol file: 63938-25-0.mol

Synonyms:63938-25-0;Ergoline-8-beta-carboxamide, N-benzyloxy-9,10-didehydro-6-methyl-;IEC;N-Benzyloxy-9,10-didehydro-6-methylergoline-8-beta-carboxamide;DTXSID10213765;N-Benzyloxy-9,10-didehydro-6-methylergoline-8beta-carboxamide;LS-64330;Ergoline-8-carboxamide, 9,10-didehydro-6-methyl-N-(phenylmethoxy)-, (8.beta.)-

Chemical Property of Ergoline-8-beta-carboxamide, N-benzyloxy-9,10-didehydro-6-methyl-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 60.85000
• Density: 1.31g/cm³
• LogP: 4.06380
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 373.17902698
• Heavy Atom Count: 28
• Complexity: 615

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CC(C=C2C1CC3=CNC4=CC=CC2=C34)C(=O)NOCC5=CC=CC=C5
• Isomeric SMILES: CN1C[C@@H](C=C2[C@H]1CC3=CNC4=CC=CC2=C34)C(=O)NOCC5=CC=CC=C5

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