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64622-45-3

64622-45-3 Structure

64622-45-3 Structure
IdentificationBack Directory
[Name]

Ibuprofen Piconol
[CAS]

64622-45-3
[Synonyms]

BO-36
BE 100
Staderm
U 75630
Vesicum
Pimeprofen
Pimeprophen
Einecs 264-979-8
Ibuprofenpiconol
Ibuprofen Piconol ISO 9001:2015 REACH
2-pyridylmethyl 2-(4-isobutylphenyl)propionate
(p-Isobutylphenyl)propionic acid 2-pyridylmethyl ester
2-Pyridylmethyl 2-(p-(2-methylpropyl)phenyl)propionate
2-(p-Isobutylphenyl)propionic acid 2-pyridylmethyl ester
2-(4-Isobutyl-phenyl)-propionic acid pyridin-2-ylMethyl ester
α-Methyl-4-(2-methylpropyl)benzeneacetic acid (pyridin-2-yl)methyl ester
alpha-Methyl-4-(2-methylpropyl)benzeneacetic acid 2-pyridinylmethyl ester
Benzeneacetic acid, alpha-methyl-4-(2-methylpropyl)-, 2-pyridinylmethyl ester
[EINECS(EC#)]

264-979-8
[Molecular Formula]

C19H23NO2
[MOL File]

64622-45-3.mol
[Molecular Weight]

297.39
Chemical PropertiesBack Directory
[Boiling point ]

438.9°C (rough estimate)
[density ]

1.0971 (rough estimate)
[refractive index ]

1.5000 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Acetone (Slightly), Chloroform (Slightly), Methanol (Sparingly)
[form ]

Oil
[pka]

3.36±0.12(Predicted)
[color ]

Colourless
[InChI]

InChI=1S/C19H23NO2/c1-14(2)12-16-7-9-17(10-8-16)15(3)19(21)22-13-18-6-4-5-11-20-18/h4-11,14-15H,12-13H2,1-3H3
[InChIKey]

ACEWLPOYLGNNHV-UHFFFAOYSA-N
[SMILES]

C(C1C=CC(CC(C)C)=CC=1)(C)C(=O)OCC1N=CC=CC=1
Hazard InformationBack Directory
[Description]

Pimaprofen (ibuprofen piconol) is an antiinflammatory agent useful in the topical treatment of acute and chronic eczema, and contact and atopic dermatitis.
[Originator]

Hisamitsu (Japan)
[Uses]

Ibuprofen Piconol is an anti-inflammatory agent that can be synthesized from Ibuprofen (I140000), which is a selective cyclooxygenase inhibitor.
[Definition]

ChEBI: Ibuprofen piconol is an organic molecular entity.
[Brand name]

BESICUM; STADERM
[Synthesis]

3L three-necked reaction flask was added DMF (1L), 2-chloromethylpyridine hydrochloride (144.3g), sodium carbonate (243g), and reacted for half an hour at room temperature. Add ibuprofen sodium (200g), raise the temperature to 60 ℃, reaction 24h, reduce t
Spectrum DetailBack Directory
[Spectrum Detail]

Ibuprofen Piconol(64622-45-3)1HNMR
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