(S)-3-((((9H-Fluoren-9-YL)methoxy)carbonyl)amino)-3-(4-chlorophenyl)propanoic acid

Base Information

• Chemical Name: (S)-3-((((9H-Fluoren-9-YL)methoxy)carbonyl)amino)-3-(4-chlorophenyl)propanoic acid
• CAS No.: 479064-91-0
• Molecular Formula: C24H20ClNO4
• Molecular Weight: 421.87
• DSSTox Substance ID: DTXSID50427506
• Wikidata: Q72477810
• Mol file: 479064-91-0.mol

Synonyms:479064-91-0;(S)-3-((((9H-FLUOREN-9-YL)METHOXY)CARBONYL)AMINO)-3-(4-CHLOROPHENYL)PROPANOIC ACID;Fmoc-(S)-3-Amino-3-(4-chlorophenyl)propionic acid;Fmoc-(S)-3-Amino-3-(4-chloro-phenyl)-propionic acid;(3S)-3-(4-chlorophenyl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid;(3S)-3-(4-Chlorophenyl)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid;DTXSID50427506;MFCD03427998;SC1157;(S)-Fmoc-4-chlorophenyl-|A-Phe-OH;(S)-Fmoc-4-chlorophenyl-beta-Phe-OH;AKOS015919792;CS-W013857;AC-22027;PS-12375;EN300-658053;A827374;Fmoc-(S)-3-Amino-3-(4-chlorophenyl)Propanoic acid;(S)-3-(FMOC-AMINO)-3-(4-CHLOROPHENYL)PROPANOIC ACID;(S)-3-((((9H-FLUOREN-9-YL)METHOXY)CARBONYL)AMINO)-3-(4-CHLOROPHENYL)PROPANOICACID;Benzenepropanoic acid,4-chloro-b-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-,(bS)-

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

Chemical Property:

• Vapor Pressure: 2.27E-17mmHg at 25°C
• Refractive Index: 1.637
• Boiling Point: 642.204 °C at 760 mmHg
• PKA: 4.22±0.10(Predicted)
• Flash Point: 342.193 °C
• Density: 1.336 g/cm³
• Storage Temp.: 2-8°C
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 421.1080858
• Heavy Atom Count: 30
• Complexity: 584

Purity/Quality:

99% ^*data from raw suppliers

Fmoc-(s)-3-amino-3-(4-chlorophenyl)propionicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC(=O)O)C4=CC=C(C=C4)Cl
• Isomeric SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC(=O)O)C4=CC=C(C=C4)Cl
• Uses: Fmoc-(s)-3-amino-3-(4-chlorophenyl)propionic acid