3-[(Tert-butoxycarbonyl)amino]-3-(2-methylphenyl)propanoic acid

Base Information

• Chemical Name: 3-[(Tert-butoxycarbonyl)amino]-3-(2-methylphenyl)propanoic acid
• CAS No.: 284493-54-5
• Molecular Formula: C15H21NO4
• Molecular Weight: 279.33
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID10377432
• Mol file: 284493-54-5.mol

Synonyms:284493-54-5;3-[(tert-butoxycarbonyl)amino]-3-(2-methylphenyl)propanoic acid;3-((tert-Butoxycarbonyl)amino)-3-(o-tolyl)propanoic acid;3-(2-methylphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic Acid;Boc-3-Amino-3-(2-methylphenyl)propionic acid;3-tert-Butoxycarbonylamino-3-o-tolyl-propionic acid;3-{[(tert-butoxy)carbonyl]amino}-3-(2-methylphenyl)propanoic acid;Boc-(R)-3-Amino-3-(2-methyl-phenyl)-propionic acid;Boc-b-Phe(2-Me)-OH;SCHEMBL19744371;DTXSID10377432;MFCD02090696;AKOS005071250;AB15114;AB15191;4-(1-Butyl)-2,2,2-trifluoroacetophenone;FT-0654627;FT-0680668;FT-0772894;A50437;EN300-743797;8R-0641;boc-dl-3-amino-3-(2-methyl-phenyl)-propionic acid;Boc-(R)-3-Amino-3-(2-methyl-phenyl)-propionicacid;Boc-(S)-3-Amino-3-(2-methyl-phenyl)-propionicacid;3-((tert-Butoxycarbonyl)amino)-3-(o-tolyl)propanoicacid

Chemical Property of 3-[(Tert-butoxycarbonyl)amino]-3-(2-methylphenyl)propanoic acid

Chemical Property:

• Melting Point: 137-139°C
• PSA: 75.63000
• LogP: 3.42640
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 279.14705815
• Heavy Atom Count: 20
• Complexity: 348

Purity/Quality:

98.5% ^*data from raw suppliers

3-[(tert-Butoxycarbonyl)amino]-3-(2-methylphenyl)propanoic acid >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1C(CC(=O)O)NC(=O)OC(C)(C)C