Dimethyl N-(phosphonoacetyl)-L-aspartate

Base Information

• Chemical Name: Dimethyl N-(phosphonoacetyl)-L-aspartate
• CAS No.: 76385-65-4
• Molecular Formula: C₈H₁₄NO₈P
• Molecular Weight: 283.175
• DSSTox Substance ID: DTXSID80514498
• Wikidata: Q82374862

Synonyms:76385-65-4;Dimethyl N-(phosphonoacetyl)-L-aspartate;DTXSID80514498

Chemical Property of Dimethyl N-(phosphonoacetyl)-L-aspartate

Chemical Property:

• XLogP3: -2.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 283.04570340
• Heavy Atom Count: 18
• Complexity: 375

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CC(C(=O)OC)NC(=O)CP(=O)(O)O
• Isomeric SMILES: COC(=O)C[C@@H](C(=O)OC)NC(=O)CP(=O)(O)O

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