P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester
TL;DR: P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester (CAS 3772-42-7) is a chemical compound with molecular formula C17H28N2O2 and molecular weight 292.2151 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(diethylamino)ethyl 4-(butylamino)benzoate
Also Known As: Farmocaine, T-Caine, Dicaine, 2-(Diethylamino)ethyl 4-(butylamino)benzoate, Tetracaine Impurity 10
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H28N2O2 |
| Molecular Weight | 292.2151 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 292.2151 Da |
| Heavy Atoms | 21 |
| Complexity | 272.0 |
| SMILES | CCCCNC1=CC=C(C=C1)C(=O)OCCN(CC)CC |
| InChIKey | JQMCLLAJJLVYOC-UHFFFAOYSA-N |
Product Description
Applications: P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester (CAS 3772-42-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester (CAS 3772-42-7) is a pharmaceutical intermediate with the molecular formula C17H28N2O2 and a molecular weight of 292.22 g/mol. It is also known as Farmocaine and T-Caine.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester
Property Insights of P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester
The XLogP value of 4.5 indicates that P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.6 Ų, P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester?
The CAS number of P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester is 3772-42-7.
What is the molecular formula of P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester?
The molecular formula of P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester is C17H28N2O2.
What is the molecular weight of P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester?
The molecular weight of P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester is 292.2151 g/mol.
What are the applications of P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester?
P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester?
You can request a quote for P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester?
Yes, CoreyChem provides custom synthesis services for P-(butylamino)benzoic acid-2-(diethylamino)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.