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4-Isobutyl-alpha-methylphenylacetic acid, 99%, Thermo Scientific Chemicals

Catalog No. AAB2098903
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Ibuprofen is useful as a nonsteroidal anti-inflammatory research chemical. Ibuprofen is reported to inhibit the netrophil-dependent edema response of rabbit skin to C5a/PGE23. NSAID that inhibits cyclooxygenase-1 and -2.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
Ibuprofen is useful as a nonsteroidal anti-inflammatory research chemical. Ibuprofen is reported to inhibit the netrophil-dependent edema response of rabbit skin to C5a/PGE23. NSAID that inhibits cyclooxygenase-1 and -2.

Solubility
Insoluble in water. Soluble in ethanol (25 mg/ml), chloroform (1:1), ether (1:2), acetone (1:1.5), aqueous solutions of alkali hydroxides and carbonates, dichloromethane, methanol (50 mg/ml), and ethyl acetate.

Notes
Store away from oxidizing agents. Keep the container tightly closed and place it in a cool, dry and well ventilated condition.

Chemical Identifiers

CAS

15687-27-1

Molecular Formula

C13H18O2

Molecular Weight (g/mol)

206.29

MDL Number

MFCD00010393

InChI Key

HEFNNWSXXWATRW-UHFFFAOYNA-N

Synonym

ibuprofen, 2-4-isobutylphenyl propanoic acid, motrin, brufen, nurofen, advil, dolgit, liptan, nuprin, anflagen

PubChem CID

3672

ChEBI

CHEBI:5855

IUPAC Name

2-[4-(2-methylpropyl)phenyl]propanoic acid

SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(O)=O

Specifications

Melting Point

75°C to 78°C

Boiling Point

157°C (4 mmHg)

Odor

Odorless

Quantity

1 g

UN Number

UN3077

Merck Index

14,4881

Solubility Information

Insoluble in water. Soluble in ethanol (25mg/ml),chloroform (1:1),ether (1:2),acetone (1:1.5),aqueous solutions of alkali hydroxides and carbonates,dichloromethane,methanol (50mg/ml),and ethyl acetate.

Formula Weight

206.29

Percent Purity

99%

Chemical Name or Material

4-Isobutyl-alpha-methylphenylacetic acid

Hazard Category

H302-H319-H335

Hazard Statement

GHS H Statement
H301-H361
Toxic if swallowed.
Suspected of damaging fertility or the unborn child.

Precautionary Statement

P260-P264b-P270-P271-P280i-P301+P312-P304+P340-P305+P351+P338-P312-P314-P330-P501c

DOTInformation

Transport Hazard Class: 9; Packing Group: III; Proper Shipping Name: ENVIRONMENTALLY HAZARDOUS SUBSTANCES, SOLID, N.O.S.

EINECSNumber

239-784-6

RTECSNumber

MU6640000

TSCA

Yes

Recommended Storage

Ambient temperatures

RUO – Research Use Only

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