ISODEHYDROACETIC ACID

Base Information

Chemical Name:ISODEHYDROACETIC ACID
CAS No.:480-65-9
Molecular Formula:C8H8O4
Molecular Weight:168.149
Hs Code.:29329900
European Community (EC) Number:207-554-4
NSC Number:408066,34551
UNII:Y755M7L6DC
DSSTox Substance ID:DTXSID80197386
Nikkaji Number:J13.182B
Wikidata:Q83070266
ChEMBL ID:CHEMBL1892918
Mol file:480-65-9.mol

Synonyms:Coumalicacid, 4,6-dimethyl- (6CI);Glutaconic acid, 4-(1-hydroxyethylidene)-3-methyl-, d-lactone (7CI);2-Pentenedioicacid, 4-(1-hydroxyethylidene)-3-methyl-, d-lactone;4,6-Dimethylcoumalic acid;Acetic acid,isodehydro-;Isodehydracetic acid;Isodehydroacetic acid;NSC 34551;NSC 408066;

Suppliers and Price of ISODEHYDROACETIC 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
4,6-DIMETHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID
25mg
$ 45.00

Sigma-Aldrich
ISODEHYDRACETIC ACID Aldrich
25mg
$ 144.00

Sigma-Aldrich
4,6-DIMETHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID Aldrich
50mg
$ 144.00

Matrix Scientific
4,6-Dimethyl-2-oxo-2H-pyran-5-carboxylic acid 97%
1g
$ 360.00

Crysdot
4,6-DIMETHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID 97%
5g
$ 749.00

Chemenu
4,6-DIMETHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID 95%+
250mg
$ 195.00

Atlantic Research Chemicals
4,6-DIMETHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID 95%
250mgs:
$ 60.09

American Custom Chemicals Corporation
4,6-DIMETHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID 95.00%
10G
$ 2079.00

American Custom Chemicals Corporation
4,6-DIMETHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID 95.00%
5G
$ 1432.20

American Custom Chemicals Corporation
4,6-DIMETHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID 95.00%
1G
$ 947.10

Total 21 raw suppliers

Chemical Property of ISODEHYDROACETIC ACID

Chemical Property:

Vapor Pressure:0.000215mmHg at 25°C
Melting Point:154-156 °C
Refractive Index:1.4530 (estimate)
Boiling Point:303.4 °C at 760 mmHg
Flash Point:125.8 °C
PSA：67.51000
Density:1.326 g/cm³
LogP:0.95480
XLogP3:0.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:168.04225873
Heavy Atom Count:12
Complexity:309

Purity/Quality:

99%, ^*data from raw suppliers

4,6-DIMETHYL-2-OXO-2H-PYRAN-5-CARBOXYLIC ACID ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36
Safety Statements: 24/25-26

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=O)OC(=C1C(=O)O)C

Technology Process of ISODEHYDROACETIC ACID

There total 8 articles about ISODEHYDROACETIC 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: 92.0%