2-Isopropyl-1,3-dioxane-5-carboxylic Acid

Base Information

Chemical Name:2-Isopropyl-1,3-dioxane-5-carboxylic Acid
CAS No.:116193-72-7
Molecular Formula:C8H14 O4
Molecular Weight:174.197
Hs Code.:
European Community (EC) Number:418-170-3,445-770-2
DSSTox Substance ID:DTXSID70921955,DTXSID301214940
Mol file:116193-72-7.mol

Synonyms:116193-72-7;2-Isopropyl-1,3-dioxane-5-carboxylic Acid;1,3-Dioxane-5-carboxylic acid, 2-(1-methylethyl)-;TRANS-2-ISOPROPYL-5-CARBOXY-1,3-DIOXANE;2-propan-2-yl-1,3-dioxane-5-carboxylic acid;EC 418-170-3;2-(propan-2-yl)-1,3-dioxane-5-carboxylic acid;1,3-Dioxane-5-carboxylicacid,2-(1-methylethyl)-(9CI);42031-28-7;SCHEMBL7749699;DTXSID70921955;LAMFNZWIXHJCMW-FKQCQYRASA-N;LAMFNZWIXHJCMW-UHFFFAOYSA-N;DTXSID301214940;EX-A4792;DB-251538;NS00003002;NS00114758;Rel-(2r,5r)-2-isopropyl-1,3-dioxane-5-carboxylic acid;trans-2-(1-Methylethyl)-1,3-dioxane-5-carboxylic acid

Suppliers and Price of 2-Isopropyl-1,3-dioxane-5-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

TRC
2-Isopropyl-1,3-dioxane-5-carboxylicAcid
100mg
$ 155.00

Medical Isotopes, Inc.
2-Isopropyl-1,3-dioxane-5-carboxylicAcid
1 g
$ 2120.00

Total 30 raw suppliers

Chemical Property of 2-Isopropyl-1,3-dioxane-5-carboxylic Acid

Chemical Property:

PSA：55.76000
LogP:0.71610
Solubility.:Chloroform
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:174.08920892
Heavy Atom Count:12
Complexity:158

Purity/Quality:

99.9% ^*data from raw suppliers

2-Isopropyl-1,3-dioxane-5-carboxylicAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)C1OCC(CO1)C(=O)O
Uses Intermediate in the preparation of Iobitridol.

Technology Process of 2-Isopropyl-1,3-dioxane-5-carboxylic Acid

There total 1 articles about 2-Isopropyl-1,3-dioxane-5-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:

: 116193-72-7
2-(2-propyl)-1,3-dioxane-5-carboxylic acid

Guidance literature:: aus Dicarbonsaeure (14) durch Thermolyse;
DOI:10.1021/ja00756a029

Reference yield: 95.7%

: 116193-72-7
2-(2-propyl)-1,3-dioxane-5-carboxylic acid

: 35453-19-1
2,4,6-triiodo-5-aminoisophthalic acid

: C₁₆H₁₆I₃NO₇

Guidance literature:: 2-(2-propyl)-1,3-dioxane-5-carboxylic acid; With N,N-dimethyl acetamide; bis(trichloromethyl) carbonate; In dichloromethane; at 0 ℃; for 0.5h;

2,4,6-triiodo-5-aminoisophthalic acid; In dichloromethane; at 0 - 50 ℃; for 16h;

Reference yield: 87.9%

: 116193-72-7
2-(2-propyl)-1,3-dioxane-5-carboxylic acid

: 154921-11-6
dimethyl 5-amino-2,4,6-triiodo-1,3-benzenedicarboxylate

: C₁₈H₂₀I₃NO₇

Guidance literature:: 2-(2-propyl)-1,3-dioxane-5-carboxylic acid; With N,N-dimethyl acetamide; bis(trichloromethyl) carbonate; In dichloromethane; at 0 ℃; for 0.5h;

dimethyl 5-amino-2,4,6-triiodo-1,3-benzenedicarboxylate; In dichloromethane; at 0 - 50 ℃; for 16h;