Benzocaine Methanethiosulfonate
TL;DR: Benzocaine Methanethiosulfonate (CAS 212207-24-4) is a chemical compound with molecular formula C10H13NO4S2 and molecular weight 275.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfonylsulfanylethyl 4-aminobenzoate
Also Known As: Benzocaine Methanethiosulfonate, 2-methylsulfonylsulfanylethyl 4-aminobenzoate, 2-((Methylsulfonyl)thio)ethyl 4-aminobenzoate, 2-(4-Aminobenzoyloxy)ethyl Methanethiosulfonate, 2-[(Methanesulfonyl)sulfanyl]ethyl 4-aminobenzoate
| Molecular Formula | C10H13NO4S2 |
|---|---|
| Molecular Weight | 275.03 g/mol |
| LogP | 1.1184 |
| Topological Polar Surface Area | 86.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.0286 |
| Heavy Atoms | 17 |
| Complexity | 481.5323 |
Chemical Identifiers
| CAS Number | 212207-24-4 |
|---|---|
| SMILES | CS(=O)(=O)SCCOC(=O)C1=CC=C(C=C1)N |
Product Overview
Benzocaine Methanethiosulfonate (CAS 212207-24-4), with molecular formula C10H13NO4S2 and molecular weight 275.03 g/mol. IUPAC: 2-methylsulfonylsulfanylethyl 4-aminobenzoate.
Chemical Property Profile of Benzocaine Methanethiosulfonate
Property Insights of Benzocaine Methanethiosulfonate
The XLogP value of 1.1184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzocaine Methanethiosulfonate. The TPSA of 86.46 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzocaine Methanethiosulfonate. Following Lipinski's Rule of Five, Benzocaine Methanethiosulfonate has 1 hydrogen bond donor(s) and 6 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 Benzocaine Methanethiosulfonate?
The CAS number of Benzocaine Methanethiosulfonate is 212207-24-4.
What is the molecular formula of Benzocaine Methanethiosulfonate?
The molecular formula of Benzocaine Methanethiosulfonate is C10H13NO4S2.
What is the molecular weight of Benzocaine Methanethiosulfonate?
The molecular weight of Benzocaine Methanethiosulfonate is 275.03 g/mol.
Where can I buy Benzocaine Methanethiosulfonate?
You can request a quote for Benzocaine Methanethiosulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzocaine Methanethiosulfonate?
Yes, KEHONG BIO provides custom synthesis services for Benzocaine Methanethiosulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.