Trolnitrate phosphate

Base Information

• Chemical Name: Trolnitrate phosphate
• CAS No.: 588-42-1
• Molecular Formula: C6H12N4O9•2H3O4P
• Molecular Weight: 480.22
• European Community (EC) Number: 209-617-1
• UNII: 13330D1K2A
• DSSTox Substance ID: DTXSID50207527
• Wikidata: Q27251462
• ChEMBL ID: CHEMBL3989711
• Mol file: 588-42-1.mol

Synonyms:Angitrit;triethanolamine trinitrate;trolnitrate;trolnitrate phosphate (1:2)

Chemical Property of Trolnitrate phosphate

Chemical Property:

• Melting Point: 107-109°
• PSA: 343.53000
• LogP: -1.37430
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 9
• Exact Mass: 480.01421911
• Heavy Atom Count: 29
• Complexity: 297

Purity/Quality:

99% ^*data from raw suppliers

TROLNITRATE PHOSPHATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CO[N+](=O)[O-])N(CCO[N+](=O)[O-])CCO[N+](=O)[O-].OP(=O)(O)O.OP(=O)(O)O
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