2-Piperidinethione, 1-[(1R)-2-hydroxy-1-phenylethyl]-6-methyl-, (6S)-

Base Information

• Chemical Name: 2-Piperidinethione, 1-[(1R)-2-hydroxy-1-phenylethyl]-6-methyl-, (6S)-
• CAS No.: 683771-94-0
• Molecular Formula: C14H19NOS
• Molecular Weight: 249.37200
• DSSTox Substance ID: DTXSID10477441
• Nikkaji Number: J2.030.126K
• Wikidata: Q82310109

Synonyms:683771-94-0;2-Piperidinethione, 1-[(1R)-2-hydroxy-1-phenylethyl]-6-methyl-, (6S)-;DTXSID10477441

Chemical Property of 2-Piperidinethione, 1-[(1R)-2-hydroxy-1-phenylethyl]-6-methyl-, (6S)-

Chemical Property:

• PSA: 55.56000
• LogP: 2.85970
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 249.11873540
• Heavy Atom Count: 17
• Complexity: 263

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CCCC(=S)N1C(CO)C2=CC=CC=C2
• Isomeric SMILES: C[C@H]1CCCC(=S)N1[C@@H](CO)C2=CC=CC=C2

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