L-Alanine, N-(N-(((ethoxymethylphosphinothioyl)thio)acetyl)-beta-alanyl)-, ethyl ester

Base Information

• Chemical Name: L-Alanine, N-(N-(((ethoxymethylphosphinothioyl)thio)acetyl)-beta-alanyl)-, ethyl ester
• CAS No.: 68030-52-4
• Molecular Formula: C13H24N2O5PS2+
• Molecular Weight: 383.4433
• DSSTox Substance ID: DTXSID70987475
• Wikidata: Q82975724

Synonyms:68030-52-4;L-Alanine, N-(N-(((ethoxymethylphosphinothioyl)thio)acetyl)-beta-alanyl)-, ethyl ester;DTXSID70987475;Ethyl N-(8,12-dihydroxy-5-sulfanylidene-3-oxa-6-thia-9-aza-5-phosphoniadodec-8-en-12-ylidene)alaninate

Chemical Property of L-Alanine, N-(N-(((ethoxymethylphosphinothioyl)thio)acetyl)-beta-alanyl)-, ethyl ester

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 13
• Exact Mass: 383.08642622
• Heavy Atom Count: 23
• Complexity: 423

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC[P+](=S)SCC(=O)NCCC(=O)NC(C)C(=O)OCC
• Isomeric SMILES: CCOC[P+](=S)SCC(=O)NCCC(=O)N[C@@H](C)C(=O)OCC

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