(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(2,4-dichlorophenyl)butanoic acid

Base Information

• Chemical Name: (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(2,4-dichlorophenyl)butanoic acid
• CAS No.: 270063-49-5
• Molecular Formula: C25H21Cl2NO4
• Molecular Weight: 470.34
• DSSTox Substance ID: DTXSID801133064
• Mol file: 270063-49-5.mol

Synonyms:270063-49-5;(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(2,4-dichlorophenyl)butanoic acid;Fmoc-(S)-3-Amino-4-(2,4-dichloro-phenyl)-butyric acid;Fmoc-2,4-dichloro-L-beta-homophenylalanine;(3S)-4-(2,4-dichlorophenyl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic acid;Fmoc-(S)-3-amino-4-(2,4-dichlorophenyl)-butyric acid;Fmoc-(S)-3-amino-4-(2,4-dichlorophenyl)butyric acid;Fmoc-(S)-3-amino-4-(2,4-dichlorophenyl)butanoic acid;DTXSID801133064;AKOS016843701;DS-3921;FD10085;AC-22171;CS-0061676;(betaS)-2,4-Dichloro-beta-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]benzenebutanoic acid;(S)-3-(((9H-fluoren-9-yl)methoxy)carbonylamino)-4-(2,4-dichlorophenyl)butanoic acid

Chemical Property of (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(2,4-dichlorophenyl)butanoic acid

Chemical Property:

• Vapor Pressure: 5.41E-19mmHg at 25°C
• Refractive Index: 1.633
• Boiling Point: 672.315 °C at 760 mmHg
• PKA: 4.30±0.10(Predicted)
• Flash Point: 360.403 °C
• PSA: 75.63000
• Density: 1.368 g/cm³
• LogP: 6.30880
• Storage Temp.: 2-8°C
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 469.0847635
• Heavy Atom Count: 32
• Complexity: 640

Purity/Quality:

98% ^*data from raw suppliers

Fmoc-(S)-3-amino-4-(2,4-dichlorophenyl)butyricacid ^*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(CC4=C(C=C(C=C4)Cl)Cl)CC(=O)O
• Isomeric SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=C(C=C(C=C4)Cl)Cl)CC(=O)O