3-[(2-Hydroxyethyl)thio]-D-valine

Base Information

• Chemical Name: 3-[(2-Hydroxyethyl)thio]-D-valine
• CAS No.: 84915-44-6
• Molecular Formula: C₇H₁₅NO₃S
• Molecular Weight: 193.267
• DSSTox Substance ID: DTXSID801299181

Synonyms:3-[(2-Hydroxyethyl)thio]-D-valine;DTXSID801299181;84915-44-6

Chemical Property of 3-[(2-Hydroxyethyl)thio]-D-valine

Chemical Property:

• XLogP3: -2.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 193.07726451
• Heavy Atom Count: 12
• Complexity: 161

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MSDS Files:

Useful:

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

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