Procaine Borate
TL;DR: Procaine Borate (CAS 149-13-3) is a chemical compound with molecular formula C13H25B5N2O12 and molecular weight 456.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 4-aminobenzoate;oxoborinic acid
Also Known As: Procaine borate, Procaine borate [NF], Vitamin H3 borate, 2-(Diethylamino)ethyl p-aminobenzoate borate (1:5), boric acid;2-(diethylamino)ethyl 4-aminobenzoate
| Molecular Formula | C13H25B5N2O12 |
|---|---|
| Molecular Weight | 456.19 g/mol |
| LogP | -3.52 |
| Topological Polar Surface Area | 242.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 455.19092 |
| Heavy Atoms | 32 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 149-13-3 |
|---|---|
| SMILES | B(=O)O.B(=O)O.B(=O)O.B(=O)O.B(=O)O.CCN(CC)CCOC(=O)C1=CC=C(C=C1)N |
| InChIKey | GTQXPCWVIUCJCK-UHFFFAOYSA-N |
Product Overview
Procaine Borate (CAS 149-13-3), with molecular formula C13H25B5N2O12 and molecular weight 456.19 g/mol. IUPAC: 2-(diethylamino)ethyl 4-aminobenzoate;oxoborinic acid.
Chemical Property Profile of Procaine Borate
Property Insights of Procaine Borate
The XLogP value of -3.52 indicates that Procaine Borate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 242.0 Ų indicates high polarity, suggesting Procaine Borate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Procaine Borate has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Procaine Borate?
The CAS number of Procaine Borate is 149-13-3.
What is the molecular formula of Procaine Borate?
The molecular formula of Procaine Borate is C13H25B5N2O12.
What is the molecular weight of Procaine Borate?
The molecular weight of Procaine Borate is 456.19 g/mol.
Where can I buy Procaine Borate?
You can request a quote for Procaine Borate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Procaine Borate?
Yes, KEHONG BIO provides custom synthesis services for Procaine Borate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.