3,3'-Phosphinicobis[propanoic acid]

Base Information

• Chemical Name: 3,3'-Phosphinicobis[propanoic acid]
• CAS No.: 5961-84-2
• Molecular Formula: C6H11O6P
• Molecular Weight: 210.12
• DSSTox Substance ID: DTXSID801293490
• ChEMBL ID: CHEMBL3120856
• Mol file: 5961-84-2.mol

Synonyms:SCHEMBL2403116;CHEMBL3120856;DTXSID801293490;3,3'-Phosphinicobis[propanoic acid];STK039765;AKOS003600140;3,3'-(hydroxyphosphoryl)dipropanoic acid;3-[(2-carboxyethyl)(hydroxy)phosphoryl]propanoic acid;5961-84-2

Chemical Property of 3,3'-Phosphinicobis[propanoic acid]

Chemical Property:

• Melting Point: 159-160 °C(Solv: acetone (67-64-1); acetic acid (64-19-7))
• Boiling Point: 638.6±40.0 °C(Predicted)
• PSA: 121.71000
• Density: 1.517±0.06 g/cm3(Predicted)
• LogP: 0.20620
• XLogP3: -2.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 210.02932506
• Heavy Atom Count: 13
• Complexity: 226

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CP(=O)(CCC(=O)O)O)C(=O)O