Barium bis(5-oxo-L-prolinate)

Base Information

• Chemical Name: Barium bis(5-oxo-L-prolinate)
• CAS No.: 85959-44-0
• Molecular Formula: C5H7 N O3 . 1/2 Ba
• Molecular Weight: 393.53908
• European Community (EC) Number: 289-037-3
• DSSTox Substance ID: DTXSID40235293
• Mol file: 85959-44-0.mol

Synonyms:Barium bis(5-oxo-L-prolinate);85959-44-0;EINECS 289-037-3;SCHEMBL9648891;DTXSID40235293;NS00092587;NS00092588

Chemical Property of Barium bis(5-oxo-L-prolinate)

Chemical Property:

• PSA: 145.44000
• LogP: -2.21120
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 393.974783
• Heavy Atom Count: 19
• Complexity: 149

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(=O)NC1C(=O)[O-].C1CC(=O)NC1C(=O)[O-].[Ba+2]
• Isomeric SMILES: C1CC(=O)N[C@@H]1C(=O)[O-].C1CC(=O)N[C@@H]1C(=O)[O-].[Ba+2]