Tert-butyl 2-formylazepane-1-carboxylate

Base Information

Chemical Name:Tert-butyl 2-formylazepane-1-carboxylate
CAS No.:146337-41-9
Molecular Formula:C₁₂H₂₁NO₃
Molecular Weight:227.304
Hs Code.:2933990090
DSSTox Substance ID:DTXSID50439629
Mol file:146337-41-9.mol

Synonyms:146337-41-9;Tert-butyl 2-formylazepane-1-carboxylate;1-BOC-2-AZEPANECARBALDEHYDE;2-FORMYL-AZEPANE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;1H-Azepine-1-carboxylic acid, 2-formylhexahydro-, 1,1-dimethylethyl ester;SCHEMBL14398395;DTXSID50439629;SB33711;Tert-butyl2-formylazepane-1-carboxylate;CS-0079134;FT-0737767

Suppliers and Price of Tert-butyl 2-formylazepane-1-carboxylate

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

J&W Pharmlab
2-Formyl-azepane-1-carboxylicacidtert-butylester 98%
1g
$ 998.00

Crysdot
tert-Butyl2-formylazepane-1-carboxylate 95+%
1g
$ 518.00

Chemenu
2-Formyl-azepane-1-carboxylicacidtert-butylester 95%
1g
$ 489.00

American Custom Chemicals Corporation
1-BOC-2-AZEPANECARBALDEHYDE 95.00%
5MG
$ 505.38

Alichem
tert-Butyl2-formylazepane-1-carboxylate
1g
$ 459.98

Total 9 raw suppliers

Chemical Property of Tert-butyl 2-formylazepane-1-carboxylate

Chemical Property:

PSA：46.61000
LogP:2.30290
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:227.15214353
Heavy Atom Count:16
Complexity:258

Purity/Quality:

97% ^*data from raw suppliers

2-Formyl-azepane-1-carboxylicacidtert-butylester 98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1CCCCCC1C=O

Technology Process of Tert-butyl 2-formylazepane-1-carboxylate

There total 4 articles about Tert-butyl 2-formylazepane-1-carboxylate 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: 40.0%

: 123387-52-0
N-Boc-perhydroazepine

: 68-12-2,33513-42-7
N,N-dimethyl-formamide

: 146337-41-9
tert-butyl 2-formyl-1-azepanecarboxylate

Guidance literature:: N-Boc-perhydroazepine; With N,N,N,N,-tetramethylethylenediamine; sec.-butyllithium; In diethyl ether;

N,N-dimethyl-formamide;
DOI:10.3987/COM-16-13432

Reference yield:

: 111-49-9
hexamethylene imine

: 146337-41-9
tert-butyl 2-formyl-1-azepanecarboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 81 percent / tetrahydrofuran / 1) 0 deg C to RT, 2) RT, 30 min

2: 1) TMEDA, s-BuLi

With N,N,N,N,-tetramethylethylenediamine; sec.-butyllithium; In tetrahydrofuran;
DOI:10.1021/jo00057a024

Reference yield:

: 24424-99-5
di-tert-butyl dicarbonate

: 146337-41-9
tert-butyl 2-formyl-1-azepanecarboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 81 percent / tetrahydrofuran / 1) 0 deg C to RT, 2) RT, 30 min

2: 1) TMEDA, s-BuLi

With N,N,N,N,-tetramethylethylenediamine; sec.-butyllithium; In tetrahydrofuran;
DOI:10.1021/jo00057a024