(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-methoxyphenyl)propanoic acid

Base Information

• Chemical Name: (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-methoxyphenyl)propanoic acid
• CAS No.: 501015-30-1
• Molecular Formula: C25H23 N O5
• Molecular Weight: 417.45
• European Community (EC) Number: 873-819-1
• DSSTox Substance ID: DTXSID60427496
• Wikidata: Q72478591
• Mol file: 501015-30-1.mol

Synonyms:501015-30-1;(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-methoxyphenyl)propanoic acid;FMOC-BETA-(S)-4-METHOXYPHENYLALANINE;(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(4-methoxyphenyl)propanoic acid;(3S)-3-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)-3-(4-methoxyphenyl)propanoic acid;DTXSID60427496;Fmoc-4-Methoxy-L-b-phenylalanine;MFCD03427976;AKOS016843727;AC-25439;AS-47869;CS-0181517;EN300-650346;F16415;A871660;fmoc-(s)-3-amino-3-(4-methoxyphenyl)propanoic acid;fmoc-(S)-3-amino-3-(4-methoxy-phenyl)-propionic acid, AldrichCPR;Benzenepropanoicacid, b-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-methoxy-,(bS)-

Chemical Property of (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-methoxyphenyl)propanoic acid

Chemical Property:

• Boiling Point: 648.9±55.0 °C(Predicted)
• PKA: 4.34±0.10(Predicted)
• PSA: 84.86000
• Density: 1.273±0.06 g/cm3(Predicted)
• LogP: 5.14060
• Storage Temp.: 2-8°C
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 417.15762283
• Heavy Atom Count: 31
• Complexity: 595

Purity/Quality:

99% ^*data from raw suppliers

(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-methoxyphenyl)propanoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C(CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
• Isomeric SMILES: COC1=CC=C(C=C1)[C@H](CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24