4-Hydroxyketorolac
TL;DR: 4-Hydroxyketorolac (CAS 111930-01-9) is a chemical compound with molecular formula C15H13NO4 and molecular weight 271.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-hydroxybenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid
Also Known As: p-Hydroxyketorolac, 4-Hydroxy Ketorolac, 4-Hydroxyketorolac, Ketorolac Impurity 26, Ketorolac Impurity 37
| Molecular Formula | C15H13NO4 |
|---|---|
| Molecular Weight | 271.08 g/mol |
| LogP | 1.9966 |
| Topological Polar Surface Area | 79.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.08447 |
| Heavy Atoms | 20 |
| Complexity | 684.3991 |
Chemical Identifiers
| CAS Number | 111930-01-9 |
|---|---|
| SMILES | C1CN2C(=CC=C2C(=O)C3=CC=C(C=C3)O)C1C(=O)O |
Product Overview
4-Hydroxyketorolac (CAS 111930-01-9), with molecular formula C15H13NO4 and molecular weight 271.08 g/mol. IUPAC: 5-(4-hydroxybenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid.
Chemical Property Profile of 4-Hydroxyketorolac
Property Insights of 4-Hydroxyketorolac
The XLogP value of 1.9966 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxyketorolac. The TPSA of 79.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxyketorolac. Following Lipinski's Rule of Five, 4-Hydroxyketorolac has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Hydroxyketorolac?
The CAS number of 4-Hydroxyketorolac is 111930-01-9.
What is the molecular formula of 4-Hydroxyketorolac?
The molecular formula of 4-Hydroxyketorolac is C15H13NO4.
What is the molecular weight of 4-Hydroxyketorolac?
The molecular weight of 4-Hydroxyketorolac is 271.08 g/mol.
Where can I buy 4-Hydroxyketorolac?
You can request a quote for 4-Hydroxyketorolac directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxyketorolac?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxyketorolac and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.