Bicyclo[3.3.1]nonane-3,7-dicarboxylic acid

Base Information

Chemical Name:Bicyclo[3.3.1]nonane-3,7-dicarboxylic acid
CAS No.:6221-58-5
Molecular Formula:C11H16O4
Molecular Weight:212.25
Hs Code.:2917209090
DSSTox Substance ID:DTXSID80499392
Wikidata:Q82350131
Mol file:6221-58-5.mol

Synonyms:bicyclo[3.3.1]nonane-3,7-dicarboxylic acid;6221-58-5;Bicyclo[3,3,1]nonane-3,7-dicarboxylic acid;DTXSID80499392;AKOS022650737;AE-848/00990034;endo,endo-bicyclo[3.3.1]nonane-3,7-dicarboxylic acid

Suppliers and Price of Bicyclo[3.3.1]nonane-3,7-dicarboxylic 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

Atlantic Research Chemicals
Bicyclo[3,3,1]nonane-3,7-dicarboxylicacid 95%
1gm:
$ 420.61

AK Scientific
Bicyclo[3,3,1]nonane-3,7-dicarboxylicacid
1g
$ 807.00

Total 4 raw suppliers

Chemical Property of Bicyclo[3.3.1]nonane-3,7-dicarboxylic acid

Chemical Property:

Melting Point:128-130 °C
Boiling Point:422.8±38.0 °C(Predicted)
PKA:4.39±0.40(Predicted)
PSA：74.60000
Density:1.284±0.06 g/cm3(Predicted)
LogP:1.59810
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:212.10485899
Heavy Atom Count:15
Complexity:246

Purity/Quality:: Bicyclo[3,3,1]nonane-3,7-dicarboxylicacid 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C2CC(CC1CC(C2)C(=O)O)C(=O)O

Technology Process of Bicyclo[3.3.1]nonane-3,7-dicarboxylic acid

There total 2 articles about Bicyclo[3.3.1]nonane-3,7-dicarboxylic 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:

: 6221-58-5,33838-77-6,64395-88-6
Bicyclo[3.3.1]nonane-3,7-dicarboxylic acid

Guidance literature:: Dion III, HIO4;
DOI:10.1016/S0040-4039(01)97092-3

Reference yield:

: 6221-58-5
bicyclo[3.3.1]nonane-3,7-dicarboxylic acid

Guidance literature:: Homoadamantanon 1) SeO3, 2) Perjodsaeure;

Reference yield:

: 6221-58-5
bicyclo[3.3.1]nonane-3,7-dicarboxylic acid

: 16808-41-6
2-(adamantan-1-yl)isoindoline-1,3-dione

: N-{1-[2-(2-cyanoethyl)]adamantyl}phthalimide

Guidance literature:: Multi-step reaction with 8 steps

1.1: thionyl chloride / 3 h / Reflux

1.2: Reflux

2.1: potassium tert-butylate / ethanol; 1,2-dimethoxyethane / 4.67 h / 0 - 50 °C / Inert atmosphere

3.1: potassium hydroxide / water; ethanol / 70 h / 20 °C

4.1: thionyl chloride / 1 h / Reflux

4.2: 0 °C

5.1: benzene / 2 h / Reflux

5.2: 26 h

6.1: water; sulfuric acid / 72 h / 110 - 115 °C

7.1: N,N-dimethyl-formamide / 48 h / Reflux

8.1: potassium carbonate / water; acetone / 1 h / Inert atmosphere; Irradiation

With thionyl chloride; sulfuric acid; potassium tert-butylate; water; potassium carbonate; potassium hydroxide; In 1,2-dimethoxyethane; ethanol; water; N,N-dimethyl-formamide; acetone; benzene;
DOI:10.1002/ejoc.201600491