(S)-Benzyl 4-isobutyl-2,5-dioxooxazolidine-3-carboxylate

Base Information

• Chemical Name: (S)-Benzyl 4-isobutyl-2,5-dioxooxazolidine-3-carboxylate
• CAS No.: 125814-24-6
• Molecular Formula: C₁₅H₁₇NO₅
• Molecular Weight: 291.304
• DSSTox Substance ID: DTXSID401152923
• Mol file: 125814-24-6.mol

Synonyms:125814-24-6;Z-L-leucine N-carboxyanhydride;(S)-Benzyl 4-isobutyl-2,5-dioxooxazolidine-3-carboxylate;Benzyl (4S)-4-(2-methylpropyl)-2,5-dioxo-1,3-oxazolidine-3-carboxylate;DTXSID401152923;(S)-Benzyl4-isobutyl-2,5-dioxooxazolidine-3-carboxylate;Phenylmethyl (4S)-4-(2-methylpropyl)-2,5-dioxo-3-oxazolidinecarboxylate

Chemical Property of (S)-Benzyl 4-isobutyl-2,5-dioxooxazolidine-3-carboxylate

Chemical Property:

• PSA: 72.91000
• LogP: 2.65460
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 291.11067264
• Heavy Atom Count: 21
• Complexity: 414

Purity/Quality:

98% ^*data from raw suppliers

(S)-Benzyl4-isobutyl-2,5-dioxooxazolidine-3-carboxylate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CC1C(=O)OC(=O)N1C(=O)OCC2=CC=CC=C2
• Isomeric SMILES: CC(C)C[C@H]1C(=O)OC(=O)N1C(=O)OCC2=CC=CC=C2

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