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

Base Information

• Chemical Name: (S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(2-chlorophenyl)butanoic acid
• CAS No.: 270596-37-7
• Molecular Formula: C25H22ClNO4
• Molecular Weight: 435.9
• DSSTox Substance ID: DTXSID301140030
• Mol file: 270596-37-7.mol

Synonyms:270596-37-7;(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(2-chlorophenyl)butanoic acid;Fmoc-(S)-3-amino-4-(2-chlorophenyl)-butyric acid;Fmoc-(S)-3-Amino-4-(2-chloro-phenyl)-butyric acid;(3S)-4-(2-chlorophenyl)-3-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic Acid;Fmoc-(S)-3-Amino-4-(2-chlorophenyl)butyric acid;Fmoc-2-chloro-L-beta-homophenylalanine;Fmoc-(R)-3-amino-4-(2-chlorophenyl)butanoic acid;DTXSID301140030;MFCD01860997;AKOS015948768;FD10049;AC-22154;AS-48780;CS-0062185;Fmoc-(S)-3-amino-4-(2-chloro-phenyl)-butyric acid, AldrichCPR;(betaS)-2-Chloro-beta-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]benzenebutanoic acid;(S)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(2-chlorophenyl)butanoicacid;(S)-3-(((9H-fluoren-9-yl)methoxy)carbonylamino)-4-(2-chlorophenyl)butanoic acid

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

Chemical Property:

• Vapor Pressure: 5.62E-18mmHg at 25°C
• Melting Point: 142-143 °C
• Refractive Index: 1.628
• Boiling Point: 653.6 °C at 760 mmHg
• PKA: 4.34±0.10(Predicted)
• Flash Point: 349.1 °C
• PSA: 75.63000
• Density: 1.313 g/cm³
• LogP: 5.65540
• Storage Temp.: 2-8°C
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 435.1237359
• Heavy Atom Count: 31
• Complexity: 607

Purity/Quality:

98%min ^*data from raw suppliers

Fmoc-2-chloro-L-beta-homophenylalanine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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