Fmoc-3,4-dichloro-L-phenylalanine

Base Information

• Chemical Name: Fmoc-3,4-dichloro-L-phenylalanine
• CAS No.: 177966-59-5
• Molecular Formula: C24H19Cl2NO4
• Molecular Weight: 456.32
• Hs Code.: 2922498590
• European Community (EC) Number: 810-601-7
• DSSTox Substance ID: DTXSID10939014
• Wikidata: Q72478261
• Mol file: 177966-59-5.mol

Synonyms:177966-59-5;Fmoc-3,4-dichloro-L-phenylalanine;Fmoc-L-3,4-dichlorophe;(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(3,4-dichlorophenyl)propanoic acid;Fmoc-L-3,4-dichloroPhe-OH;(2S)-3-(3,4-dichlorophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid;17766-59-5;3,4-Dichloro-L-phenylalanine, N-FMOC protected;Fmoc-Phe(3,4-Cl2)-OH;Fmoc-L-3,4-Dichlorophenylalanine;SCHEMBL119309;DTXSID10939014;FMOC-L-PHE(3,4-DICL)-OH;MFCD00273473;3,4-DICHLORO-N-[(9H-FLUOREN-9-YLMETHOXY)CARBONYL]-L-PHENYLALANINE;AKOS015837332;AC-9885;AM82045;DS-8272;(2S)-3-(3,4-dichlorophenyl)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]propanoic acid;CS-0101066;A50189;EN300-3408802;A812322;Fmoc-Phe(3,4-Cl2)-OH, >=96.0% (HPLC);J-011308;N-Fluorenemethoxycarbonyl-L-3,4-Dichloro Phenylalanine;Fmoc-L-3,4-Dichlorophenylalanine (Fmoc-L-Phe(3,4-diCl)-OH);L-Phenylalanine, 3,4-dichloro-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-;(2S)-3-(3,4-dichlorophenyl)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid;(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(3,4-dichlorophenyl)propanoicacid;3,4-Dichloro-N-{[(9H-fluoren-9-yl)methoxy](hydroxy)methylidene}phenylalanine;(S)-2-(((9H-FLUOREN-9-YL)METHOXY)CARBONYLAMINO)-3-(3,4-DICHLOROPHENYL)PROPANOIC ACID

Chemical Property of Fmoc-3,4-dichloro-L-phenylalanine

Chemical Property:

• Melting Point: 122 °C
• Boiling Point: 661.7 °C at 760 mmHg
• PKA: 3?+-.0.10(Predicted)
• Flash Point: 354 °C
• PSA: 75.63000
• Density: 1.394 g/cm³
• LogP: 5.91870
• Storage Temp.: 2-8°C
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 455.0691135
• Heavy Atom Count: 31
• Complexity: 625

Purity/Quality:

97% ^*data from raw suppliers

Fmoc-3,4-dichloro-L-phenylalanine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CC(=C(C=C4)Cl)Cl)C(=O)O
• Isomeric SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC(=C(C=C4)Cl)Cl)C(=O)O
• Uses: Fmoc-L-3,4-dichloroPhe-OH