Ibuprofen, (+-)-
TL;DR: Ibuprofen, (+-)- (CAS 15687-27-1) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(2-methylpropyl)phenyl]propanoic acid
Also Known As: ibuprofen, Motrin, Brufen, Advil, 2-(4-Isobutylphenyl)propanoic acid
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H18O2 |
| Molecular Weight | 206.13068 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 206.13068 Da |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
| Melting Point | 75-77.5 ºC |
| Boiling Point | 157 |
| Vapor Pressure | 4.74X10-5 mm Hg @ 25 °C |
| Solubility | 21 |
| SMILES | CC(C)CC1=CC=C(C=C1)C(C)C(=O)O |
| InChIKey | HEFNNWSXXWATRW-UHFFFAOYSA-N |
Chemical Property Profile of Ibuprofen, (+-)-
Property Insights of Ibuprofen, (+-)-
The XLogP value of 3.5 indicates that Ibuprofen, (+-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Ibuprofen, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ibuprofen, (+-)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ibuprofen, (+-)-?
The CAS number of Ibuprofen, (+-)- is 15687-27-1.
What is the molecular formula of Ibuprofen, (+-)-?
The molecular formula of Ibuprofen, (+-)- is C13H18O2.
What is the molecular weight of Ibuprofen, (+-)-?
The molecular weight of Ibuprofen, (+-)- is 206.13068 g/mol.
Where can I buy Ibuprofen, (+-)-?
You can request a quote for Ibuprofen, (+-)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ibuprofen, (+-)-?
Yes, CoreyChem provides custom synthesis services for Ibuprofen, (+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.