piperolactam C

Base Information

• Chemical Name: piperolactam C
• CAS No.: 116064-76-7
• Molecular Formula: C18H15 N O4
• Molecular Weight: 309.32
• UNII: RDL2GAQ3BL
• DSSTox Substance ID: DTXSID301260931
• Nikkaji Number: J790.696J
• Wikidata: Q105024241
• Metabolomics Workbench ID: 48259
• ChEMBL ID: CHEMBL250441
• Mol file: 116064-76-7.mol

Synonyms:piperolactam C;116064-76-7;13,14,15-trimethoxy-10-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2,4,6,8,12,14-heptaen-11-one;1,2,3-Trimethoxydibenz[cd,f]indol-4(5H)-one;13,14,15-trimethoxy-10-azatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(15),2,4,6,8,12(16),13-heptaen-11-one;O-Methylpiperolactam B;RDL2GAQ3BL;Piperolactam B methyl ether;CHEMBL250441;CHEBI:174960;DTXSID301260931;AKOS032948924;FS-9474;Dibenz[cd,f]indol-4(5H)-one, 1,2,3-trimethoxy-;1,2,3-Trimethoxydibenz[cd,f]indol-4(5H)-one, 9CI

Chemical Property of piperolactam C

Chemical Property:

• Melting Point: 189-190 °C
• Boiling Point: 467.2±45.0 °C(Predicted)
• PKA: 11.34±0.20(Predicted)
• PSA: 60.55000
• Density: 1.324±0.06 g/cm3(Predicted)
• LogP: 3.29810
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 309.10010796
• Heavy Atom Count: 23
• Complexity: 470

Purity/Quality:

99% ^*data from raw suppliers

PiperolactamC ≥98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C(=C2C3=C1C4=CC=CC=C4C=C3NC2=O)OC)OC