1-Ethyl 4-((phosphono-3-pyridinylmethyl)amino)benzoate

Base Information

• Chemical Name: 1-Ethyl 4-((phosphono-3-pyridinylmethyl)amino)benzoate
• CAS No.: 160092-85-3
• Deprecated CAS: 182228-01-9
• Molecular Formula: C15H17N2O5P
• Molecular Weight: 336.28
• DSSTox Substance ID: DTXSID00936219

Synonyms:1-Ethyl 4-((phosphono-3-pyridinylmethyl)amino)benzoate;Benzoic acid, 4-((phosphono-3-pyridinylmethyl)amino)-, 1-ethyl ester;160092-85-3;C15H17N2O5P;DTXSID00936219;C15-H17-N2-O5-P;LS-38180;{[4-(Ethoxycarbonyl)anilino](pyridin-3-yl)methyl}phosphonic acid

Chemical Property of 1-Ethyl 4-((phosphono-3-pyridinylmethyl)amino)benzoate

Chemical Property:

• Vapor Pressure: 1.34E-15mmHg at 25°C
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 336.08750864
• Heavy Atom Count: 23
• Complexity: 434

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C1=CC=C(C=C1)NC(C2=CN=CC=C2)P(=O)(O)O

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