Methyl 2-(4-isobutylphenyl)propanoate

Base Information Edit

Chemical Name:Methyl 2-(4-isobutylphenyl)propanoate
CAS No.:61566-34-5
Deprecated CAS:114376-60-2
Molecular Formula:C14H20O2
Molecular Weight:220.312
Hs Code.:2916399090
European Community (EC) Number:262-853-7
UNII:8F58KSV2GP
DSSTox Substance ID:DTXSID00921342
Nikkaji Number:J125.909A,J712.450C
Wikidata:Q27270289
ChEMBL ID:CHEMBL191471
Mol file:61566-34-5.mol

Synonyms:61566-34-5;Methyl 2-(4-isobutylphenyl)propanoate;Ibuprofen methyl ester;methyl 2-[4-(2-methylpropyl)phenyl]propanoate;METHYL2-(4-ISOBUTYLPHENYL)PROPANOATE;Motrin methyl ester;Methyl 2-(4-isobutylphenyl)propionate;2-(4-Isobutylphenyl)propionic acid methyl ester;Racemic ibuprofen methyl ester;(+/-)-Ibuprofen methyl ester;UNII-8F58KSV2GP;8F58KSV2GP;Ibuprofen methyl ester, racemic;EINECS 262-853-7;Methyl 2-(p-isobutylphenyl)propionate;Methyl 2-(4'-isobutylphenyl)propanoate;Benzeneacetic acid, .alpha.-methyl-4-(2-methylpropyl)-, methyl ester;(2R/S)-2-(4-Isobutylphenyl)-propionic acid methyl ester;Ibuprofen methyl;ibuprofen methylester;ibuprofen-methyl-ester;Ibuprofen methyl deriv;Methyl ester of Ibuprofen;Ibuprofen, Methyl Deriv.;Ibuprofen methyl derivative;SCHEMBL576873;CHEMBL191471;DTXSID00921342;BBL103755;MFCD00869922;STL557565;AKOS025213841;Methyl 2-(4-isopropylphenyl)propionate;methyl 2-(4isobutyl-phenyl)-propionate;methyl alpha-(4-isobutylphenyl)propionate;CS-0154243;FT-0628383;2-(p-isobutylphenyl)propionic acid methyl ester;D81971;methyl 2-(4-isobutylphenyl)propanoate, AldrichCPR;METHYL .ALPHA.-(4-ISOBUTYLPHENYL)PROPIONATE;METHYL .ALPHA.-(P-ISOBUTYLPHENYL)PROPIONATE;( inverted exclamation markA)-Ibuprofen Methyl Ester;Q27270289;2-[4-(2-methyl-propyl)-phenyl]-propionic acid methyl ester;Benzeneacetic acid,a-methyl-4-(2-methylpropyl)-,methyl ester;114376-60-2

Suppliers and Price of Methyl 2-(4-isobutylphenyl)propanoate

Supply Marketing:Edit

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

Ambeed
Methyl2-(4-isobutylphenyl)propanoate 97%
250mg
$ 6.00

Ambeed
Methyl2-(4-isobutylphenyl)propanoate 97%
1g
$ 15.00

Ambeed
Methyl2-(4-isobutylphenyl)propanoate 97%
5g
$ 55.00

Ambeed
Methyl2-(4-isobutylphenyl)propanoate 97%
25g
$ 183.00

American Custom Chemicals Corporation
METHYL 2-(4-ISOBUTYLPHENYL)PROPANOATE 95.00%
1G
$ 156.02

American Custom Chemicals Corporation
METHYL 2-(4-ISOBUTYLPHENYL)PROPANOATE 95.00%
10G
$ 1484.83

Atlantic Research Chemicals
Methyl2-(4-isobutylphenyl)propanoate 95%
10gm:
$ 388.80

Atlantic Research Chemicals
Methyl2-(4-isobutylphenyl)propanoate 95%
1gm:
$ 53.02

SynQuest Laboratories
Methyl 2-(4-isobutylphenyl)propanoate
250 mg
$ 64.00

SynQuest Laboratories
Methyl 2-(4-isobutylphenyl)propanoate
1 g
$ 135.00

Total 30 raw suppliers

Chemical Property of Methyl 2-(4-isobutylphenyl)propanoate Edit

Chemical Property:

Vapor Pressure:0.00254mmHg at 25°C
Refractive Index:1.493
Boiling Point:287.1 °C at 760 mmHg
Flash Point:101.5 °C
PSA：26.30000
Density:0.976 g/cm³
LogP:3.16160
Storage Temp.:Sealed in dry,Room Temperature
Solubility.:Chloroform (Slightly), Ethyl Acetate (Slightly)
XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:220.146329876
Heavy Atom Count:16
Complexity:215

Purity/Quality:

99% ^*data from raw suppliers

Methyl2-(4-isobutylphenyl)propanoate 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38-43
Safety Statements: 26-36/37/39-36/37

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)CC1=CC=C(C=C1)C(C)C(=O)OC
Uses (±)-Ibuprofen Methyl Ester is a phototoxic, photoproduct of Ibuprofen (I140000), a selective cyclooxygenase inhibitor (IC50=14.9uM). Inhibits PGH synthase-1 and PGH synthase-2 with comparable potency. Ibuprofen is also used as an anti-inflammatory drug.

Technology Process of Methyl 2-(4-isobutylphenyl)propanoate

There total 47 articles about Methyl 2-(4-isobutylphenyl)propanoate 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: 100.0%