(2S)-3-Methyl-2-{[(2,2,2-trichloroethoxy)carbonyl]amino}butanoic acid

Base Information

• Chemical Name: (2S)-3-Methyl-2-{[(2,2,2-trichloroethoxy)carbonyl]amino}butanoic acid
• CAS No.: 78221-33-7
• Molecular Formula: C8H12Cl3NO4
• Molecular Weight: 292.547
• DSSTox Substance ID: DTXSID301257586

Synonyms:78221-33-7;DTXSID301257586;N-[(2,2,2-Trichloroethoxy)carbonyl]-L-valine;(2S)-3-METHYL-2-{[(2,2,2-TRICHLOROETHOXY)CARBONYL]AMINO}BUTANOIC ACID

Chemical Property of (2S)-3-Methyl-2-{[(2,2,2-trichloroethoxy)carbonyl]amino}butanoic acid

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 290.983191
• Heavy Atom Count: 16
• Complexity: 265

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)C(C(=O)O)NC(=O)OCC(Cl)(Cl)Cl
• Isomeric SMILES: CC(C)[C@@H](C(=O)O)NC(=O)OCC(Cl)(Cl)Cl

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