2-[(tert-Butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylic acid

Base Information

Chemical Name:2-[(tert-Butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylic acid
CAS No.:870288-16-7
Molecular Formula:C12H19NO4
Molecular Weight:241.28400
Hs Code.:
DSSTox Substance ID:DTXSID50694337
Mol file:870288-16-7.mol

Synonyms:870288-16-7;2-[(tert-Butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylic acid;DTXSID50694337;AB50614;EN300-342611;(1R,2S)-Boc-2-aminocyclohex-3-ene-carboxylicacid;2-{[(tert-butoxy)carbonyl]amino}cyclohex-3-ene-1-carboxylic acid;131784-79-7

Suppliers and Price of 2-[(tert-Butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylic acid

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

Matrix Scientific
(1R,2S)-Boc-2-aminocyclohex-3-ene-carboxylic acid
50mg
$ 535.00

American Custom Chemicals Corporation
CIS-2-TERT-BUTOXYCARBONYLAMINO-CYCLOHEX-3-ENECARBOXYLIC ACID 95.00%
5MG
$ 497.56

Total 5 raw suppliers

Chemical Property of 2-[(tert-Butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylic acid

Chemical Property:

Vapor Pressure:1.73E-07mmHg at 25°C
Boiling Point:399.2oC at 760 mmHg
Flash Point:195.2oC
PSA：75.63000
Density:1.15g/cm3
LogP:2.32140
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:241.13140809
Heavy Atom Count:17
Complexity:330

Purity/Quality:

98%min ^*data from raw suppliers

(1R,2S)-Boc-2-aminocyclohex-3-ene-carboxylic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)NC1C=CCCC1C(=O)O

Technology Process of 2-[(tert-Butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylic acid

There total 3 articles about 2-[(tert-Butoxycarbonyl)amino]cyclohex-3-ene-1-carboxylic 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: 88.0%

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

: 131783-54-5,132487-40-2,142035-00-5
(1R,2S)-2-Amino-cyclohex-3-enecarboxylic acid; hydrochloride

: 870288-16-7,233600-33-4
(1R,2S)-2-(tert-butoxycarbonylamino)cyclohex-3-enecarboxylic acid

Guidance literature:: With sodium hydroxide; In 1,4-dioxane; water; at 20 ℃; for 4h;
DOI:10.1002/ejoc.200500297

Reference yield: 87.0%

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

: 193673-65-3,285560-96-5,285560-97-6,473835-79-9,785015-46-5
(1R,2S)-cis-2-aminocyclohex-3-enecarboxylic acid

: 870288-16-7,233600-33-4
(1R,2S)-2-(tert-butoxycarbonylamino)cyclohex-3-enecarboxylic acid

Guidance literature:: With sodium hydroxide; In tetrahydrofuran; water; at 0 ℃; for 12h;
DOI:10.1039/c1ob05648d

Reference yield:

: rac,cis-7-azabicyclo<4.2.0>-oct-4-en-8-one

: 870288-16-7,233600-33-4
(1R,2S)-2-(tert-butoxycarbonylamino)cyclohex-3-enecarboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: CAL-B

2: sodium hydroxide / tetrahydrofuran; water / 12 h / 0 °C

With sodium hydroxide; In tetrahydrofuran; water;
DOI:10.1039/c1ob05648d