Proparacaine Impurity 33
TL;DR: Proparacaine Impurity 33 (CAS 754936-74-8) is a chemical compound with molecular formula C13H19ClN2O2 and molecular weight 270.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 3-amino-4-chlorobenzoate
Also Known As: Proparacaine Impurity 33, 2-diethylaminoethyl 3-amino-4-chlorobenzoate, 2-diethylaminoethyl 3-amino-4-chloro-benzoate, 2-(diethylamino)ethyl 3-amino-4-chlorobenzoate
| Molecular Formula | C13H19ClN2O2 |
|---|---|
| Molecular Weight | 270.11 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 270.1135 |
| Heavy Atoms | 18 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 754936-74-8 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC(=C(C=C1)Cl)N |
| InChIKey | YVULPTRVRVTWAA-UHFFFAOYSA-N |
Product Overview
Proparacaine Impurity 33 (CAS 754936-74-8), with molecular formula C13H19ClN2O2 and molecular weight 270.11 g/mol. IUPAC: 2-(diethylamino)ethyl 3-amino-4-chlorobenzoate.
Chemical Property Profile of Proparacaine Impurity 33
Property Insights of Proparacaine Impurity 33
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Proparacaine Impurity 33. With a topological polar surface area (TPSA) of 55.6 Ų, Proparacaine Impurity 33 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Proparacaine Impurity 33 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
Frequently Asked Questions
What is the CAS number of Proparacaine Impurity 33?
The CAS number of Proparacaine Impurity 33 is 754936-74-8.
What is the molecular formula of Proparacaine Impurity 33?
The molecular formula of Proparacaine Impurity 33 is C13H19ClN2O2.
What is the molecular weight of Proparacaine Impurity 33?
The molecular weight of Proparacaine Impurity 33 is 270.11 g/mol.
Where can I buy Proparacaine Impurity 33?
You can request a quote for Proparacaine Impurity 33 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Proparacaine Impurity 33?
Yes, KEHONG BIO provides custom synthesis services for Proparacaine Impurity 33 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.