Dimethocaine hydrochloride
TL;DR: Dimethocaine hydrochloride (CAS 553-63-9) is a chemical compound with molecular formula C16H27ClN2O2 and molecular weight 314.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(diethylamino)-2,2-dimethylpropyl] 4-aminobenzoate;hydrochloride
Also Known As: Dimethocaine hydrochloride, Larocaine, Dimethocaine HCl, Larocaine hydrochloride, Larokain
| Molecular Formula | C16H27ClN2O2 |
|---|---|
| Molecular Weight | 314.18 g/mol |
| LogP | 3.22 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 314.17612 |
| Heavy Atoms | 21 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 553-63-9 |
|---|---|
| SMILES | CCN(CC)CC(C)(C)COC(=O)C1=CC=C(C=C1)N.Cl |
| InChIKey | WWTWKTDXBNHESE-UHFFFAOYSA-N |
Product Overview
Dimethocaine hydrochloride (CAS 553-63-9), with molecular formula C16H27ClN2O2 and molecular weight 314.18 g/mol. IUPAC: [3-(diethylamino)-2,2-dimethylpropyl] 4-aminobenzoate;hydrochloride.
Chemical Property Profile of Dimethocaine hydrochloride
Property Insights of Dimethocaine hydrochloride
The XLogP value of 3.22 indicates that Dimethocaine hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.6 Ų, Dimethocaine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethocaine hydrochloride has 2 hydrogen bond donor(s) and 4 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 Dimethocaine hydrochloride?
The CAS number of Dimethocaine hydrochloride is 553-63-9.
What is the molecular formula of Dimethocaine hydrochloride?
The molecular formula of Dimethocaine hydrochloride is C16H27ClN2O2.
What is the molecular weight of Dimethocaine hydrochloride?
The molecular weight of Dimethocaine hydrochloride is 314.18 g/mol.
Where can I buy Dimethocaine hydrochloride?
You can request a quote for Dimethocaine hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethocaine hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Dimethocaine hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.