(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3,3-diphenylpropanoic acid

Base Information

• Chemical Name: (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3,3-diphenylpropanoic acid
• CAS No.: 201484-50-6
• Molecular Formula: C₃₀H₂₅NO₄
• Molecular Weight: 463.533
• Hs Code.: 2922498590
• European Community (EC) Number: 621-000-2
• DSSTox Substance ID: DTXSID40942192
• Wikidata: Q72478324
• Mol file: 201484-50-6.mol

Synonyms:201484-50-6;Fmoc-L-3,3-Diphenylalanine;Fmoc-3,3-diphenyl-L-alanine;(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3,3-diphenylpropanoic acid;Fmoc-beta-phenyl-Phe-OH;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3,3-diphenylpropanoic acid;Fmoc-3,3-diphenyl-L-alaine;MFCD00672337;(S)-2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-3,3-diphenylpropanoic acid;Fmoc-3,3-diphenyl-D-alaine;Fmoc-Dph-OH;Fmoc-,-diphenyl-Ala-OH;Fmoc-(S)-2-Amino-3,3-diphenylpropanoic acid;SCHEMBL119505;DTXSID40942192;AMY22645;AKOS025117411;AC-9896;CS-W011553;DS-8285;HY-W010837;PD196739;Fmoc-L-3,3-diphenylalanine (Fmoc-L-Dip-OH);Fmoc-beta-phenyl-Phe-OH, >=98.0% (HPLC);H10955;A814286;N-Fluorenemethoxycarbonyl-L-3,3-Diphenhl Alanine;J-013056;J-505182;Fmoc-Dip-OH;Fmoc--phenyl-Phe-OH;L-Phenylalanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-beta-phenyl-;N-{[(9H-Fluoren-9-yl)methoxy](hydroxy)methylidene}-beta-phenylphenylalanine;(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3,3-diphenylpropanoicacid;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3,3-diphenyl-propanoic acid

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

Chemical Property:

• Melting Point: 125-129 ºC
• Boiling Point: 676.5±55.0 °C(Predicted)
• PKA: 3.57±0.10(Predicted)
• Flash Point: 63 ºC
• PSA: 75.63000
• Density: 1.262±0.06 g/cm3(Predicted)
• LogP: 6.20130
• Storage Temp.: 2-8°C
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 463.17835828
• Heavy Atom Count: 35
• Complexity: 673

Purity/Quality:

98%,99%, ^*data from raw suppliers

Fmoc-L-3,3-diphenylalanine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): N,Xi
• Hazard Codes: N,Xi
• Statements: 50/53
• Safety Statements: 60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35
• Isomeric SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)[C@@H](C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Technology Process of (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3,3-diphenylpropanoic acid

There total 1 articles about (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3,3-diphenylpropanoic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.0%

(fluorenylmethoxy)carbonyl chloride (28920-43-6) + 2-amino-3,3-diphenylpropionic acid (62653-26-3) → 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3,3-diphenyl-propionic acid (839719-72-1,189937-46-0,201484-50-6)

Guidance literature:

With sodium carbonate; In 1,4-dioxane; at 0 - 20 ℃; for 2h;

DOI:10.1021/jm049906w

Reference yield: 100.0%

Fmoc-Leu-preloaded Wang resin, deprotected + N-(9-fluorenylmethoxycarbonyl)-D-leucine (35661-60-0,126727-03-5,114360-54-2) + Fmoc-N-methylvaline (103478-58-6,84000-11-3) + Fmoc-3,3-diphenyl-D-alanine (189937-46-0,201484-50-6) + FMOC-(4-methoxy-D-phenylalanine) (201335-88-8) → HO-Leu-N-Me-Val-D-Leu-D-Tyr(Me)-3,3-diphenyl-D-Ala-NH2 (1610523-76-6)

Guidance literature:

Fmoc-Leu-preloaded Wang resin, deprotected; Fmoc-N-methylvaline; With benzotriazol-1-ol; diisopropyl-carbodiimide; In N,N-dimethyl-formamide; 2-chlorotrityl-leucine resin

With piperidine; In N,N-dimethyl-formamide; isopropyl alcohol; for 0.433333h; 2-chlorotrityl-leucine resin

N-(9-fluorenylmethoxycarbonyl)-D-leucine; Fmoc-3,3-diphenyl-D-alanine; FMOC-(4-methoxy-D-phenylalanine); Further stages;

DOI:10.1021/ml500114p

Reference yield: 96.0%

Fmoc-Leu-preloaded Wang resin, deprotected + Fmoc-D-3-(4-pyridyl)Ala-OH (205528-30-9) + N-(9-fluorenylmethoxycarbonyl)-D-leucine (35661-60-0,126727-03-5,114360-54-2) + Fmoc-N-methylvaline (103478-58-6,84000-11-3) + Fmoc-3,3-diphenyl-D-alanine (189937-46-0,201484-50-6) → HO-Leu-N-Me-Val-D-Leu-D-3-(4-pyridyl)Ala-3,3-diphenyl-D-Ala-NH2 (1610523-74-4)

Guidance literature:

Fmoc-Leu-preloaded Wang resin, deprotected; Fmoc-N-methylvaline; With benzotriazol-1-ol; diisopropyl-carbodiimide; In N,N-dimethyl-formamide; 2-chlorotrityl-leucine resin

With piperidine; In N,N-dimethyl-formamide; isopropyl alcohol; for 0.433333h; 2-chlorotrityl-leucine resin

Fmoc-D-3-(4-pyridyl)Ala-OH; N-(9-fluorenylmethoxycarbonyl)-D-leucine; Fmoc-3,3-diphenyl-D-alanine; Further stages;

DOI:10.1021/ml500114p

upstream raw materials:

(fluorenylmethoxy)carbonyl chloride

2-amino-3,3-diphenylpropionic acid

Refernces