2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid

Base Information

• Chemical Name: 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid
• CAS No.: 885274-45-3
• Molecular Formula: C19H28 N2 O4
• Molecular Weight: 348.44
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID00376116
• Mol file: 885274-45-3.mol

Synonyms:885274-45-3;2-(4-Boc-piperazinyl)-4-phenylbutanoic acid;2-(4-(tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid;2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-phenylbutanoic acid;2-{4-[(TERT-BUTYL)OXYCARBONYL]PIPERAZINYL-4-PHENYLBUTANOIC ACID;2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoicacid;2-[4-(tert-butoxycarbonyl)piperazin-1-yl]-4-phenylbutanoic acid;2-{4-[(tert-butyl)oxycarbonyl]piperazinyl}-4-phenylbutanoic acid;DTXSID00376116;AR3788;MFCD01862502;AKOS015902276;AS-45690;CS-0171794;FT-0763015;2-{4-[(tert-butoxy)carbonyl]piperazin-1-yl}-4-phenylbutanoic acid

Chemical Property of 2-(4-(Tert-butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoic acid

Chemical Property:

• Vapor Pressure: 2.55E-10mmHg at 25°C
• Refractive Index: 1.546
• Boiling Point: 487.6°C at 760 mmHg
• PKA: 2.45±0.10(Predicted)
• Flash Point: 248.7°C
• PSA: 70.08000
• Density: 1.162g/cm³
• LogP: 2.50090
• Storage Temp.: 2-8°C
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 348.20490738
• Heavy Atom Count: 25
• Complexity: 447

Purity/Quality:

96% 1H NMR ^*data from raw suppliers

2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-4-phenylbutanoicacid 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)N1CCN(CC1)C(CCC2=CC=CC=C2)C(=O)O