Fmoc-3-Abz-OH

Base Information

• Chemical Name: Fmoc-3-Abz-OH
• CAS No.: 185116-42-1
• Molecular Formula: C22H17NO4
• Molecular Weight: 359.381
• Hs Code.: 29242990
• European Community (EC) Number: 683-393-7
• Nikkaji Number: J1.882.366G
• Mol file: 185116-42-1.mol

Synonyms:Fmoc-3-Abz-OH;185116-42-1;Fmoc-3-aminobenzoic acid;3-(9H-fluoren-9-ylmethoxycarbonylamino)benzoic Acid;3-(Fmoc-amino)benzoic acid;3-(9-FLUORENYLMETHYLOXYCARBONYL)AMINO-BENZOIC ACID;3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)benzoic acid;MFCD00235885;3-({[(9H-FLUOREN-9-YL)METHOXY]CARBONYL}AMINO)BENZOIC ACID;Fmoc-(3)Abz-OH;Fmoc-3-aminobenozic acid;SCHEMBL118921;Fmoc - 3 - aminobenzoic acid;AKOS012711543;AS-56508;Fmoc-3-Abz-OH, >=98.0% (HPLC);CS-0204855;FT-0679802;E70513;EN300-650285;3-(9-fluorenylmethyloxycarbonyl)aminobenzoic acid;J-011865;3-(9H-Fluorene-9-ylmethoxycarbonylamino)benzoic acid;3-(((9H-fluoren-9-yl)methoxy)carbonylamino)benzoic acid;Z1136512102

Chemical Property of Fmoc-3-Abz-OH

Chemical Property:

• Vapor Pressure: 7.42E-13mmHg at 25°C
• Refractive Index: 1.684
• Boiling Point: 548.3 °C at 760 mmHg
• PKA: 4.13±0.10(Predicted)
• Flash Point: 285.4 °C
• PSA: 75.63000
• Density: 1.352 g/cm³
• LogP: 4.81880
• Storage Temp.: 2-8°C
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 359.11575802
• Heavy Atom Count: 27
• Complexity: 528

Purity/Quality:

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

Fmoc-3-aminobenzoic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC4=CC=CC(=C4)C(=O)O
• Uses: Fmoc-3-aminobenzoic acid is used in the preparation of hydrogelators with multiple applications including; drug delivery carriers.

Technology Process of Fmoc-3-Abz-OH

There total 3 articles about Fmoc-3-Abz-OH 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: 95.0%

(fluorenylmethoxy)carbonyl chloride (28920-43-6) + meta-aminobenzoic acid (99-05-8,159139-79-4) → 3-(9-fluorenylmethyloxycarbonyl)aminobenzoic acid (185116-42-1)

Guidance literature:

With sodium carbonate; In 1,4-dioxane; water; at 20 ℃; for 3h;

DOI:10.1021/acsmedchemlett.0c00154

Reference yield: 81.0%

N-(9H-fluoren-2-ylmethoxycarbonyloxy)succinimide (82911-69-1) + meta-aminobenzoic acid (99-05-8,159139-79-4) → 3-(9-fluorenylmethyloxycarbonyl)aminobenzoic acid (185116-42-1)

Guidance literature:

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

DOI:10.1021/acs.jmedchem.0c02042

Reference yield:

C22H16NO4Pol → 3-(9-fluorenylmethyloxycarbonyl)aminobenzoic acid (185116-42-1)

Guidance literature:

With triethylsilane; water; trifluoroacetic acid; In dichloromethane; at 20 ℃; for 0.166667h; 2-chlorotrityl chloride resin

upstream raw materials:

(fluorenylmethoxy)carbonyl chloride

meta-aminobenzoic acid

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

Refernces

• 1、 Lohan, Sandeep,Kalanta, Arneesh,Sonkusre, Praveen,Cameotra, Swaranjit Singh,Bisht, Gopal Singh. "Development of novel membrane active lipidated peptidomimetics active against drug resistant clinical isolates". . p. 4544 - 4552. Retrieved 2014.
• 2、 Zhang, Zuo-Peng,Zhong, Ye,Han, Zhen-Bin,Zhou, Lin,Su, Hua-Sheng,Wang, Jian,Liu, Yang,Cheng, Mao-Sheng. "Synthesis, molecular docking analysis and biological evaluations of saccharide-modified thiadiazole sulfonamide derivatives". . . Retrieved 2021/05/26.
• 3、 Gmeiner, Peter,Hübner, Harald,Kaindl, Jonas,Kl?sel, Ilona,Schmidt, Maximilian F.,Weikert, Dorothee. "Discovery of Novel Nonpeptidic PAR2 Ligands". supporting information. p. 1316 - 1323. Retrieved 2020/07/04.