N-(Ethoxycarbonothioyl)-L-aspartic acid

Base Information

• Chemical Name: N-(Ethoxycarbonothioyl)-L-aspartic acid
• CAS No.: 78255-92-2
• Molecular Formula: C7H11NO5S
• DSSTox Substance ID: DTXSID40707869
• Wikidata: Q82641845

Synonyms:N-(Ethoxycarbonothioyl)-L-aspartic acid;78255-92-2;SCHEMBL10507046;DTXSID40707869;JAKBBBNQLTYQBS-BYPYZUCNSA-N;N-ethoxythiocarbonyl-L-aspartic acid

Chemical Property of N-(Ethoxycarbonothioyl)-L-aspartic acid

Chemical Property:

• XLogP3: 0
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 221.03579362
• Heavy Atom Count: 14
• Complexity: 242

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=S)NC(CC(=O)O)C(=O)O
• Isomeric SMILES: CCOC(=S)N[C@@H](CC(=O)O)C(=O)O

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