3-(Morpholine-4-carbothioylsulfanyl)propanoic acid

Base Information

• Chemical Name: 3-(Morpholine-4-carbothioylsulfanyl)propanoic acid
• CAS No.: 81994-79-8
• Molecular Formula: C₈H₁₃NO₃S₂
• Molecular Weight: 235.328
• DSSTox Substance ID: DTXSID201331268
• ChEMBL ID: CHEMBL1895557

Synonyms:CBDivE_012416;Oprea1_210449;3-(morpholine-4-carbothioylsulfanyl)propanoic acid;81994-79-8;MLS000777843;SCHEMBL7813839;CHEMBL1895557;DTXSID201331268;HMS2750F17;STL364008;AKOS015955316;SMR000414229;3-(Morpholine-4-carbothioylsulfanyl)-propionic acid;3-[(morpholin-4-ylcarbonothioyl)sulfanyl]propanoic acid

Chemical Property of 3-(Morpholine-4-carbothioylsulfanyl)propanoic acid

Chemical Property:

• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 235.03368562
• Heavy Atom Count: 14
• Complexity: 217

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C1COCCN1C(=S)SCCC(=O)O

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