(R)-3-((tert-Butoxycarbonyl)amino)-3-(2-(trifluoromethyl)phenyl)propanoic acid

Base Information

• Chemical Name: (R)-3-((tert-Butoxycarbonyl)amino)-3-(2-(trifluoromethyl)phenyl)propanoic acid
• CAS No.: 501015-17-4
• Molecular Formula: C15H18F3NO4
• Molecular Weight: 333.304
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID70375873
• Wikidata: Q82164514
• Mol file: 501015-17-4.mol

Synonyms:501015-17-4;(R)-3-((tert-Butoxycarbonyl)amino)-3-(2-(trifluoromethyl)phenyl)propanoic acid;(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(trifluoromethyl)phenyl]propanoic acid;(R)-Boc-2-(trifluoromethyl)-beta-Phe-OH;(3R)-3-{[(tert-butoxy)carbonyl]amino}-3-[2-(trifluoromethyl)phenyl]propanoic acid;Boc-(R)-3-Amino-3-(2-trifluoromethyl-phenyl)-propionic acid;Boc-(R)-3-amino-3-(2-trifluoromethylphenyl)propionic acid;DTXSID70375873;MFCD03427963;AKOS015948833;AC-25352;AS-64362;Boc-(R)-2-trifluoromethyl-b-phenylalanine;CS-0135310;N12650;EN300-1163411;boc-(r)-3-amino-3-(2-trifluoromethylphenyl)propanoic acid;(R)-Boc-2-(trifluoromethyl)-beta-Phe-OH, >=98.0% (HPLC);(3R)-3-[(TERT-BUTOXYCARBONYL)AMINO]-3-[2-(TRIFLUOROMETHYL)PHENYL]PROPANOIC ACID;(R)-3-((tert-Butoxycarbonyl)amino)-3-(2-(trifluoromethyl)phenyl)propanoicacid

Chemical Property of (R)-3-((tert-Butoxycarbonyl)amino)-3-(2-(trifluoromethyl)phenyl)propanoic acid

Chemical Property:

• Vapor Pressure: 5.08E-08mmHg at 25°C
• Boiling Point: 426.1°C at 760 mmHg
• PKA: 4.20±0.10(Predicted)
• Flash Point: 211.5°C
• PSA: 75.63000
• Density: 1.269g/cm³
• LogP: 4.13680
• Storage Temp.: 2-8°C
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 333.11879254
• Heavy Atom Count: 23
• Complexity: 431

Purity/Quality:

98%min ^*data from raw suppliers

(R)-3-((tert-Butoxycarbonyl)amino)-3-(2-(trifluoromethyl)phenyl)propanoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1C(F)(F)F
• Isomeric SMILES: CC(C)(C)OC(=O)N[C@H](CC(=O)O)C1=CC=CC=C1C(F)(F)F