N-[1-(S)-Benzyloxycarbonyl-3-phenylpropyl]-D-alanine tert-Butyl Ester

Base Information

• Chemical Name: N-[1-(S)-Benzyloxycarbonyl-3-phenylpropyl]-D-alanine tert-Butyl Ester
• CAS No.: 1356022-42-8
• Molecular Formula: C24H31NO4
• Molecular Weight: 397.5
• DSSTox Substance ID: DTXSID00747125
• Mol file: 1356022-42-8.mol

Synonyms:1356022-42-8;N-[1-(S)-Benzyloxycarbonyl-3-phenylpropyl]-D-alanine tert-Butyl Ester;benzyl (2S)-2-[[(2R)-1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]amino]-4-phenylbutanoate;DTXSID00747125;VJVSRTMPQCZFKD-NQIIRXRSSA-N;Benzyl (2S)-2-{[(2R)-1-tert-butoxy-1-oxopropan-2-yl]amino}-4-phenylbutanoate

Chemical Property of N-[1-(S)-Benzyloxycarbonyl-3-phenylpropyl]-D-alanine tert-Butyl Ester

Chemical Property:

• Solubility.: Chloroform, Dichloromethane, Ethyl Acetate, Methanol
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 12
• Exact Mass: 397.22530847
• Heavy Atom Count: 29
• Complexity: 502

Purity/Quality:

98%min ^*data from raw suppliers

N-[1-(S)-Benzyloxycarbonyl-3-phenylpropyl]-D-alaninetert-ButylEster ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C(=O)OC(C)(C)C)NC(CCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2
• Isomeric SMILES: C[C@H](C(=O)OC(C)(C)C)N[C@@H](CCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2
• Uses: An impurity in the preparation of Imidaprilat