5-(4-Methylphenyl)-5-oxopentanoic acid

Base Information

Chemical Name:5-(4-Methylphenyl)-5-oxopentanoic acid
CAS No.:833-85-2
Molecular Formula:C12H14 O3
Molecular Weight:206.241
Hs Code.:2918300090
European Community (EC) Number:212-632-6
UNII:DA8HTW3SB7
DSSTox Substance ID:DTXSID90232257
Nikkaji Number:J195.103C
Wikidata:Q83113292
Mol file:833-85-2.mol

Synonyms:833-85-2;5-(4-Methylphenyl)-5-oxovaleric acid;5-(4-Methylphenyl)-5-oxopentanoic acid;4-p-Toluoylbutyric acid;5-Oxo-5-(p-tolyl)pentanoic acid;4-p-toluoylbutyricacid;5-Oxo-5-p-tolyl-pentanoic acid;EINECS 212-632-6;DA8HTW3SB7;4-(p-Toluoyl)butyric acid;Butyric acid, 4-p-toluoyl-;5-oxo-5-p-tolylpentanoic acid;SCHEMBL2743310;DTXSID90232257;MFCD00458564;STL301504;delta-Oxo-4-methylbenzenevaleric acid;AKOS004908134;4-methyl-delta-oxobenzenepentanoic acid;AB06076;FS-4187;5-(4-Methylphenyl)-5-oxopentanoic acid #;Benzenepentanoic acid, 4-methyl-delta-oxo-;FT-0705961;Benzenepentanoic acid, 4-methyl-.delta.-oxo-;10.14272/MCWLCBLXRSXGTF-UHFFFAOYSA-N;EN300-138548;doi:10.14272/MCWLCBLXRSXGTF-UHFFFAOYSA-N;Z361415418

Suppliers and Price of 5-(4-Methylphenyl)-5-oxopentanoic 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
5-(4-Methylphenyl)-5-oxovalericAcid
2.5g
$ 135.00

TRC
5-(4-Methylphenyl)-5-oxovalericAcid
25g
$ 1060.00

Rieke Metals
5-(4-METHYLPHENYL)-5-OXOVALERICACID
5g
$ 1943.00

Rieke Metals
5-(4-methylphenyl)-5-oxovalericacid 97%
5g
$ 1250.00

Rieke Metals
5-(4-methylphenyl)-5-oxovalericacid 97%
1g
$ 303.00

Rieke Metals
5-(4-methylphenyl)-5-oxovalericacid 97%
2g
$ 529.00

Rieke Metals
5-(4-METHYLPHENYL)-5-OXOVALERICACID
1g
$ 809.00

Medical Isotopes, Inc.
5-(4-Methylphenyl)-5-oxovalericAcid
2.5 g
$ 640.00

Matrix Scientific
5-(4-Methylphenyl)-5-oxovaleric acid 97%
1g
$ 319.00

Matrix Scientific
5-(4-Methylphenyl)-5-oxovaleric acid 97%
5g
$ 1165.00

Total 10 raw suppliers

Chemical Property of 5-(4-Methylphenyl)-5-oxopentanoic acid

Chemical Property:

Vapor Pressure:4.24E-07mmHg at 25°C
Boiling Point:399.5°C at 760 mmHg
Flash Point:209.6°C
PSA：54.37000
Density:1.137g/cm³
LogP:2.43260
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:206.094294304
Heavy Atom Count:15
Complexity:227

Purity/Quality:

98%min ^*data from raw suppliers

5-(4-Methylphenyl)-5-oxovalericAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)C(=O)CCCC(=O)O
Uses 5-(4-Methylphenyl)-5-oxovaleric Acid is a reagent that is used in the synthesis of thioxotetrahydropyrimidinyl propanoic acid derivatives as it has anti-inflammatory activities.

Technology Process of 5-(4-Methylphenyl)-5-oxopentanoic acid

There total 17 articles about 5-(4-Methylphenyl)-5-oxopentanoic 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: 95.0%

: 108-55-4
glutaric anhydride,

: 108-88-3,15644-74-3,16713-13-6
toluene

: 833-85-2
5-(4-methylphenyl)-5-oxopentanoic acid

Guidance literature:: With hydrogenchloride; aluminum (III) chloride; In dichloromethane; water; at 5 ℃; for 0.2h;

Reference yield: 88.0%

: 833-85-2
5-(4-methylphenyl)-5-oxopentanoic acid

Guidance literature:: With aluminum (III) chloride; at 0 ℃; for 1h; Reflux;

Reference yield: 72.0%

: cis-2-(p-tolyl)cyclohexanamine

: 833-85-2
5-(4-methylphenyl)-5-oxopentanoic acid

Guidance literature:: With rose bengal; oxygen; In 1,4-dioxane; at 25 ℃; for 24h; Solvent; Catalytic behavior; Irradiation;
DOI:10.1002/chem.201604440