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rac Ibuprofen-d3 - 98%cp,99%D, high purity , CAS No.121662-14-4
a selective cyclooxygenase inhibitor
Basic Description
Synonyms | Ibuprofen D3 | Ibuprofen-d3 | rac-Ibuprofen-d3 | (+/-)-Ibuprofen D3 | (+/-)-Ibuprofen-D3 | 3,3,3-trideuterio-2-[4-(2-methylpropyl)phenyl]propanoic acid | Benzeneacetic acid, alpha-(methyl-d3)-4-(2-methylpropyl)- (9CI) | (±)-Ibuprofen-d3 |
Specifications & Purity | ≥99 atom% D,≥98% |
Storage Temp | Store at -20°C |
Shipped In | Ice chest + Ice pads |
Product Description | rac Ibuprofen-d3, a selective cyclooxygenase inhibitor. Inhibits Cox-1 (PGH synthase-1) and Cox-2 (PGH synthase-2) with comparable potency. |
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Names and Identifiers
IUPAC Name | 3,3,3-trideuterio-2-[4-(2-methylpropyl)phenyl]propanoic acid |
INCHI | InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/i3D3 |
InChi Key | HEFNNWSXXWATRW-HPRDVNIFSA-N |
Canonical SMILES | OC(C(C1=CC=C(CC(C)C)C=C1)C([2H])([2H])[2H])=O |
Isomeric SMILES | [2H]C([2H])([2H])C(C1=CC=C(C=C1)CC(C)C)C(=O)O |
Alternate CAS | 15687-27-1(unlabelled) |
PubChem CID | 12225947 |
Molecular Weight | 209.3 |
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Chemical and Physical Properties
Solubility | Soluble in dichloromethane, ether, ethyl acetate, and methanol. |
Refractive Index | n20D1.52 (Predicted) |
Boil Point(°C) | ~319.6° C at 760 mmHg (Predicted) |
Melt Point(°C) | 75-77.5° C |
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Safety and Hazards(GHS)
Pictogram(s) | GHS07 |
Signal | Warning |
Hazard Statements | H302:Harmful if swallowed |
Precautionary Statements | P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P270:Do not eat, drink or smoke when using this product. P330:Rinse mouth. P301+P317:IF SWALLOWED: Get medical help. |
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