(3R)-3-{[(Benzyloxy)carbonyl]amino}-4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid

Base Information

• Chemical Name: (3R)-3-{[(Benzyloxy)carbonyl]amino}-4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid
• CAS No.: 349547-09-7
• Molecular Formula: C₂₇H₂₆N₂O₆
• Molecular Weight: 474.513
• DSSTox Substance ID: DTXSID40583448
• Wikidata: Q82475006
• Mol file: 349547-09-7.mol

Synonyms:349547-09-7;Z-beta-Dab(Fmoc)-OH;Z-Dbu(Fmoc) (R);(3R)-3-{[(Benzyloxy)carbonyl]amino}-4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid;(3R)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(phenylmethoxycarbonylamino)butanoic acid;Z-Dbu(Fmoc)(R);DTXSID40583448;(R)-4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(((benzyloxy)carbonyl)amino)butanoic acid;MFCD03788645;AKOS030214617;(Beta)-z-(gamma)-fmoc-L-3,4-diamino-;Z-beta-Dab(Fmoc)-OH, >=98.0% (HPLC);N-beta-Benzyloxycarbonyl-N-gamma-(9-fluorenylmethyloxycarbonyl)-D-3,4-diaminobutyric acid (Z-D-Dbu(Fmoc)-OH)

Chemical Property of (3R)-3-{[(Benzyloxy)carbonyl]amino}-4-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid

Chemical Property:

• Melting Point: 178-181 °C
• PSA: 113.96000
• LogP: 5.07660
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 11
• Exact Mass: 474.17908655
• Heavy Atom Count: 35
• Complexity: 703

Purity/Quality:

98.5% ^*data from raw suppliers

Z-β-Dab(Fmoc)-OH ≥98.0% (HPLC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
• Isomeric SMILES: C1=CC=C(C=C1)COC(=O)N[C@H](CC(=O)O)CNC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24