(9H-Fluoren-9-yl)methyl decyl(2-oxoethyl)carbamate

Base Information

• Chemical Name: (9H-Fluoren-9-yl)methyl decyl(2-oxoethyl)carbamate
• CAS No.: 239088-22-3
• Molecular Formula: C27H35NO3
• Molecular Weight: 421.58
• DSSTox Substance ID: DTXSID70435163
• Wikidata: Q72478826
• Mol file: 239088-22-3.mol

Synonyms:(9H-Fluoren-9-yl)methyl decyl(2-oxoethyl)carbamate;239088-22-3;9H-fluoren-9-ylmethyl N-decyl-N-(2-oxoethyl)carbamate;MFCD06411159;Carbamic acid, decyl(2-oxoethyl)-, 9H-fluoren-9-ylmethyl ester;N-FMOC-2-(n-decylamino)acetaldehyde;N-Fmoc-decylaminoacetaldehyde;SCHEMBL307644;2-[N-(9-Fluorenylmethoxycarbonyl)-N-decylamino]ethanal;DTXSID70435163;AWGULBUAOMFSCY-UHFFFAOYSA-N;AMY21469;BCP20598;BBL102990;FD6005;STL556799;AKOS016014211;AC-25884;MS-20532;CS-0320630;FT-0604023;A18505;9H-fluoren-9-ylmethyl decyl(2-oxoethyl)carbamate

Chemical Property of (9H-Fluoren-9-yl)methyl decyl(2-oxoethyl)carbamate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.547
• Boiling Point: 550.59 °C at 760 mmHg
• PKA: -1.80±0.70(Predicted)
• Flash Point: 286.787 °C
• PSA: 46.61000
• Density: 1.075 g/cm³
• LogP: 6.57710
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 7.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 14
• Exact Mass: 421.26169398
• Heavy Atom Count: 31
• Complexity: 515

Purity/Quality:

99% ^*data from raw suppliers

2-[N-(9-Fluorenylmethoxycarbonyl)-N-decylamino]ethanal ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCN(CC=O)C(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
• Uses: [N-(9-Fluorenylmethoxycarbonyl)-N-decylamino]ethanal is used in the preparation of vancomycin-related antibacterial agents.

Technology Process of (9H-Fluoren-9-yl)methyl decyl(2-oxoethyl)carbamate

There total 15 articles about (9H-Fluoren-9-yl)methyl decyl(2-oxoethyl)carbamate 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%

C41H49N3O2 → N-decyl-N-(2-oxoethyl)carbamic acid 9H-fluoren-9-ylmethyl ester (239088-22-3)

Guidance literature:

With toluene-4-sulfonic acid; In tetrahydrofuran; at 15 - 20 ℃; for 0.5h;

Reference yield: 95.0%

→ N-decyl-N-(2-oxoethyl)carbamic acid 9H-fluoren-9-ylmethyl ester (239088-22-3) + Methyl 2-Decylamidoacetate (62248-80-0)

Guidance literature:

Reference yield: 92.4%

N-(9-fluorenylmethoxycarbonyl)-N-n-decylaminoethanol (239088-19-8) → N-decyl-N-(2-oxoethyl)carbamic acid 9H-fluoren-9-ylmethyl ester (239088-22-3)

Guidance literature:

With sodium hypochlorite solution; 2,2,6,6-tetramethylpiperidin-1-ol; sodium hydrogencarbonate; potassium bromide; In dichloromethane; water; at -5 ℃; pH=8.5;

upstream raw materials:

oxalyl dichloride

N-(9-fluorenylmethoxycarbonyl)-N-n-decylaminoethanol

caprinaldehyde

1-aminodecane

Refernces

• 1、 -. "VANCOMYCIN DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF". . . Retrieved 2019/03/13.
• 2、 -. "Method for preparing telavancin side chain 9H-fluoren-9-ylmethyl decyl(2-oxoethyl)carbamate". . . Retrieved 2017/07/01.