羟丁丙卡因
TL;DR: 羟丁丙卡因 (CAS 99-43-4) is a chemical compound with molecular formula C17H28N2O3 and molecular weight 308.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟丁丙卡因
2-(diethylamino)ethyl 4-amino-3-butoxybenzoate
Also Known As: Oxybuprocaine, Benoxinate, Oxybucaine, Oxyriprocaine, Oxibuprokain
| Molecular Formula | C17H28N2O3 |
|---|---|
| Molecular Weight | 308.21 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 64.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 308.21 |
| Heavy Atoms | 22 |
| Complexity | 308.0 |
| Melting Point | 216.5 |
| Solubility | Very soluble (hydrochloride salt) |
Chemical Identifiers
| CAS Number | 99-43-4 |
|---|---|
| SMILES | CCCCOC1=C(C=CC(=C1)C(=O)OCCN(CC)CC)N |
| InChIKey | CMHHMUWAYWTMGS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羟丁丙卡因 (CAS 99-43-4), with molecular formula C17H28N2O3 and molecular weight 308.21 g/mol. IUPAC: 2-(diethylamino)ethyl 4-amino-3-butoxybenzoate.
Chemical Property Profile of 羟丁丙卡因
Property Insights of 羟丁丙卡因
The XLogP value of 3.1 indicates that Oxybuprocaine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 羟丁丙卡因. Following Lipinski's Rule of Five, Oxybuprocaine has 1 hydrogen bond donor(s) and 5 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 Oxybuprocaine?
The CAS number of Oxybuprocaine is 99-43-4.
What is the molecular formula of Oxybuprocaine?
The molecular formula of Oxybuprocaine is C17H28N2O3.
What is the molecular weight of Oxybuprocaine?
The molecular weight of Oxybuprocaine is 308.21 g/mol.
Where can I buy Oxybuprocaine?
You can request a quote for Oxybuprocaine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxybuprocaine?
Yes, KEHONG BIO provides custom synthesis services for Oxybuprocaine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.