Trinitrophenylaminolauryl triglyceride

Base Information

• Chemical Name: Trinitrophenylaminolauryl triglyceride
• CAS No.: 96337-55-2
• Molecular Formula: C57H80 N12 O24
• Molecular Weight: 1317.31
• DSSTox Substance ID: DTXSID80242209
• Wikidata: Q83125850
• Mol file: 96337-55-2.mol

Synonyms:TNPAL triglyceride;trinitrophenylaminolauryl triglyceride

Chemical Property of Trinitrophenylaminolauryl triglyceride

Chemical Property:

• PSA: 527.37000
• LogP: 19.12550
• XLogP3: 17.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 27
• Rotatable Bond Count: 47
• Exact Mass: 1316.54084147
• Heavy Atom Count: 93
• Complexity: 2160

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])NCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCNC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])OC(=O)CCCCCCCCCCCNC3=C(C=C(C=C3[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]