1H-Thioxantheno(2,1,9-def)isoquinoline-1,3(2H)-dione, 2-(1-oxooctadecyl)-

Base Information

• Chemical Name: 1H-Thioxantheno(2,1,9-def)isoquinoline-1,3(2H)-dione, 2-(1-oxooctadecyl)-
• CAS No.: 72269-57-9
• Molecular Formula: C36H43NO3S
• Molecular Weight: 569.7965
• DSSTox Substance ID: DTXSID70222590
• Nikkaji Number: J447.133D
• Wikidata: Q83100874
• Mol file: 72269-57-9.mol

Synonyms:72269-57-9;1H-Thioxantheno(2,1,9-def)isoquinoline-1,3(2H)-dione, 2-(1-oxooctadecyl)-;1H-Thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione, 2-(1-oxooctadecyl)-;C36H43NO3S;DTXSID70222590;C36-H43-N-O3-S;2-(1-Oxooctadecyl)-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione;1H-Thioxantheno[2,1,9-def] isoquinoline-1,3(2H)-dione, 2-(1-oxooctadecyl)-

Chemical Property of 1H-Thioxantheno(2,1,9-def)isoquinoline-1,3(2H)-dione, 2-(1-oxooctadecyl)-

Chemical Property:

• Vapor Pressure: 2.31E-21mmHg at 25°C
• Boiling Point: 733.3°Cat760mmHg
• Flash Point: 397.3°C
• PSA: 84.38000
• Density: 1.161g/cm³
• LogP: 10.22230
• XLogP3: 12.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 16
• Exact Mass: 569.29636541
• Heavy Atom Count: 41
• Complexity: 875

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)N1C(=O)C2=C3C(=CC=C4C3=C(C=C2)C5=CC=CC=C5S4)C1=O

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