(s)-1-(1-(Tert-butoxycarbonyl)piperidin-4-yl)pyrrolidine-2-carboxylic acid

Base Information

• Chemical Name: (s)-1-(1-(Tert-butoxycarbonyl)piperidin-4-yl)pyrrolidine-2-carboxylic acid
• CAS No.: 221352-39-2
• Molecular Formula: C15H26N2O4
• Molecular Weight: 298.38
• Hs Code.: 29333990
• European Community (EC) Number: 672-475-8
• DSSTox Substance ID: DTXSID60373565
• Mol file: 221352-39-2.mol

Synonyms:221352-39-2;l-n-[(4-boc)piperidino]proline;L-N-[4'-Boc)piperidino]proline;(s)-1-(1-(tert-butoxycarbonyl)piperidin-4-yl)pyrrolidine-2-carboxylic acid;(S)-1-(1-N-Boc-piperidin-4-yl)pyrrolidine-2-carboxylic acid;(2S)-1-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]pyrrolidine-2-carboxylic acid;(2S)-1-{1-[(tert-butoxy)carbonyl]piperidin-4-yl}pyrrolidine-2-carboxylic acid;boc-(4-piperidino)pro-oh;DTXSID60373565;MFCD01861211;AKOS015837046;TS-01079;CS-0053960;l-N-[(4'-boc)piperidino]proline, AldrichCPR;EN300-1071546;(1-(tert-butoxycarbonyl)piperidin-4-yl)-L-proline;Q-102870;1-[1-(TERT-BUTOXYCARBONYL)PIPERIDIN-4-YL]-L-PROLINE

Chemical Property of (s)-1-(1-(Tert-butoxycarbonyl)piperidin-4-yl)pyrrolidine-2-carboxylic acid

Chemical Property:

• Vapor Pressure: 1.6E-08mmHg at 25°C
• Refractive Index: 1.532
• Boiling Point: 427.9 °C at 760 mmHg
• PKA: 2.29±0.20(Predicted)
• Flash Point: 212.6 °C
• PSA: 70.08000
• Density: 1.191g/cm³
• LogP: 1.81070
• Storage Temp.: Store at -15°C
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 298.18925731
• Heavy Atom Count: 21
• Complexity: 397

Purity/Quality:

97% ^*data from raw suppliers

L-N-[4''-Boc-piperidino]proline ^*data from reagent suppliers

Safty Information:

• Pictogram(s): N
• Hazard Codes: N
• Statements: 50
• Safety Statements: 61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCC(CC1)N2CCCC2C(=O)O
• Isomeric SMILES: CC(C)(C)OC(=O)N1CCC(CC1)N2CCC[C@H]2C(=O)O