(S)-tert-Butyl (5-amino-6-((4-nitrophenyl)amino)-6-oxohexyl)carbamate

Base Information

• Chemical Name: (S)-tert-Butyl (5-amino-6-((4-nitrophenyl)amino)-6-oxohexyl)carbamate
• CAS No.: 172422-76-3
• Molecular Formula: C17H26N4O5
• Molecular Weight: 366.41
• European Community (EC) Number: 689-041-9
• DSSTox Substance ID: DTXSID00428609
• Wikidata: Q82241426
• Mol file: 172422-76-3.mol

Synonyms:172422-76-3;H-LYS(BOC)-PNA;H-L-Lys(Boc)-pNA;(S)-tert-Butyl (5-amino-6-((4-nitrophenyl)amino)-6-oxohexyl)carbamate;tert-butyl N-[(5S)-5-amino-6-(4-nitroanilino)-6-oxohexyl]carbamate;Nepsilon-Boc-L-lysine 4-nitroanilide;N-epsilon-Boc-L-lysine 4-nitroanilide;DTXSID00428609;N-|A-Boc-L-lysine 4-nitroanilide;MFCD00237144;AKOS022181120;AM81967;AS-46845;CS-0362658;F10694;A881872;N-epsilon-(t-Butyloxycarbonyl)-L-lysin-p-nitroanilide;(S)-tert-butyl 5-amino-6-(4-nitrophenylamino)-6-oxohexylcarbamate;(S)-tert-Butyl(5-amino-6-((4-nitrophenyl)amino)-6-oxohexyl)carbamate;Tert-butyl (S)-(5-amino-6-((4-nitrophenyl)amino)-6-oxohexyl)carbamate

Chemical Property of (S)-tert-Butyl (5-amino-6-((4-nitrophenyl)amino)-6-oxohexyl)carbamate

Chemical Property:

• PSA: 139.27000
• LogP: 4.24300
• Storage Temp.: -15°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 366.19031994
• Heavy Atom Count: 26
• Complexity: 479

Purity/Quality:

99% ^*data from raw suppliers

Ne-Boc-L-lysine 4-nitroanilide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NCCCCC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])N
• Isomeric SMILES: CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])N