2-(4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)phenyl)acetic acid

Base Information

• Chemical Name: 2-(4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)phenyl)acetic acid
• CAS No.: 173690-53-4
• Molecular Formula: C23H19NO4
• Molecular Weight: 373.408
• Hs Code.: 2924299090
• European Community (EC) Number: 874-055-1
• DSSTox Substance ID: DTXSID20373228
• Wikidata: Q82161395
• Mol file: 173690-53-4.mol

Synonyms:173690-53-4;2-(4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)phenyl)acetic acid;2-[4-(9H-fluoren-9-ylmethoxycarbonylamino)phenyl]acetic Acid;Fmoc-(4-aminophenyl)acetic acid;N-Fmoc-4-aminobenzeneacetic acid;(4-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}phenyl)acetic acid;2-[4-({[(9H-FLUOREN-9-YL)METHOXY]CARBONYL}AMINO)PHENYL]ACETIC ACID;SCHEMBL1001375;DTXSID20373228;HEPTACOSANOICACIDMETHYLESTER;4-(9-FLUORENYLMETHYLOXYCARBONYL-AMINO)PHENYLACETIC ACID;Benzeneacetic acid, 4-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-;MFCD01861339;AKOS012614299;AS-71831;CS-0217668;Fmoc-(4-aminophenyl)acetic acid, AldrichCPR;FT-0767701;E70605;EN300-814200;Z1123720007;2-(4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)phenyl)aceticacid

Chemical Property of 2-(4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)phenyl)acetic acid

Chemical Property:

• PSA: 75.63000
• LogP: 4.74770
• Storage Temp.: Store at?0-5°C
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 373.13140809
• Heavy Atom Count: 28
• Complexity: 535

Purity/Quality:

98%min ^*data from raw suppliers

Fmoc-4-AminophenylaceticAcid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: N
• Statements: 50
• Safety Statements: 61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC4=CC=C(C=C4)CC(=O)O

Technology Process of 2-(4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)phenyl)acetic acid

There total 2 articles about 2-(4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)phenyl)acetic 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: 94.0%

4-aminophenylacetic acid (1197-55-3) + N-(9H-fluoren-2-ylmethoxycarbonyloxy)succinimide (82911-69-1) → [4-({[(9H- fluoren-9-yl)methoxy]carbonyl}amino)phenyl]acetic acid (173690-53-4)

Guidance literature:

With sodium hydrogencarbonate; In water; acetonitrile; at 20 ℃; Cooling with ice;

DOI:10.1021/acs.jmedchem.0c02042

Reference yield: 84.0%

4-aminophenylacetic acid (1197-55-3) + (fluorenylmethoxy)carbonyl chloride (28920-43-6) → [4-({[(9H- fluoren-9-yl)methoxy]carbonyl}amino)phenyl]acetic acid (173690-53-4)

Guidance literature:

In N,N-dimethyl-formamide; at 75 ℃; for 0.5h;

DOI:10.1016/S0040-4039(98)00373-6

Reference yield:

Hydroxymethyl resin + [4-({[(9H- fluoren-9-yl)methoxy]carbonyl}amino)phenyl]acetic acid (173690-53-4) → C23H18NO4Pol

Guidance literature:

With dmap; diisopropyl-carbodiimide; In DMF (N,N-dimethyl-formamide); dichloromethane; at 50 ℃; for 12h; Mimotope synphase-PS

upstream raw materials:

4-aminophenylacetic acid

(fluorenylmethoxy)carbonyl chloride

N-(9H-fluoren-2-ylmethoxycarbonyloxy)succinimide

Refernces

• 1、 Kühl, Nikos,Leuthold, Mila M.,Behnam, Mira A. M.,Klein, Christian D.. "Beyond Basicity: Discovery of Nonbasic DENV-2 Protease Inhibitors with Potent Activity in Cell Culture". supporting information. p. 4567 - 4587. Retrieved 2021/05/06.
• 2、 -. "Maytansinoid derivatives with peptide linker and conjugates thereof". Page/Page column 103; 104. . Retrieved 2016/04/20.