Octanoic acid, 8-oxo-8-(phenyl-4-t-amino)-, ethyl ester

Base Information

Chemical Name:Octanoic acid, 8-oxo-8-(phenyl-4-t-amino)-, ethyl ester
CAS No.:265980-87-8
Molecular Formula:C₁₆H₂₃NO₃
Molecular Weight:279.356
Hs Code.:
DSSTox Substance ID:DTXSID201205982

Synonyms:DTXSID201205982;Octanoic acid, 8-oxo-8-(phenyl-4-t-amino)-, ethyl ester;265980-87-8

Suppliers and Price of Octanoic acid, 8-oxo-8-(phenyl-4-t-amino)-, ethyl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 2 raw suppliers

Chemical Property of Octanoic acid, 8-oxo-8-(phenyl-4-t-amino)-, ethyl ester

Chemical Property:

XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:10
Exact Mass:279.17601785
Heavy Atom Count:20
Complexity:285

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)CCCCCCC(=O)NC1=CC=CC=C1
Isomeric SMILES:[3H]C1=CC=C(C=C1)NC(=O)CCCCCCC(=O)OCC

Technology Process of Octanoic acid, 8-oxo-8-(phenyl-4-t-amino)-, ethyl ester

There total 3 articles about Octanoic acid, 8-oxo-8-(phenyl-4-t-amino)-, ethyl ester 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:

: 265980-86-7
monoethyl suberate 4-bromoanilide

: 265980-87-8
monoethyl suberate [4-3H]anilide

Guidance literature:: With tritium; palladium on activated charcoal; under 2068.59 Torr;
DOI:10.1002/(SICI)1099-1344(20000315)43:3<229::AID-JLCR307>3.0.CO;2-J

Reference yield:

: 14113-02-1
ethyl 8-chloro-8-oxooctanoate

: 265980-87-8
monoethyl suberate [4-3H]anilide

Guidance literature:: Multi-step reaction with 2 steps

1: 92 percent / triethylamine / CH₂Cl₂ / 16 h / 20 °C

2: tritium / Pd/C / 2068.59 Torr

With tritium; triethylamine; palladium on activated charcoal; In dichloromethane; 1: Condensation / 2: Dehalogenation;
DOI:10.1002/(SICI)1099-1344(20000315)43:3<229::AID-JLCR307>3.0.CO;2-J

Reference yield:

: 14113-01-0
Ethyl hydrogen suberate

: 265980-87-8
monoethyl suberate [4-3H]anilide

Guidance literature:: Multi-step reaction with 3 steps

1: oxalyl chloride / CH₂Cl₂

2: 92 percent / triethylamine / CH₂Cl₂ / 16 h / 20 °C

3: tritium / Pd/C / 2068.59 Torr

With tritium; oxalyl dichloride; triethylamine; palladium on activated charcoal; In dichloromethane; 1: Chlorination / 2: Condensation / 3: Dehalogenation;
DOI:10.1002/(SICI)1099-1344(20000315)43:3<229::AID-JLCR307>3.0.CO;2-J