3H-2,1-Benzoxamercurol-3-one
TL;DR: 3H-2,1-Benzoxamercurol-3-one (CAS 5722-59-8) is a chemical compound with molecular formula C7H4HgO2 and molecular weight 321.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: 3H-2,1-Benzoxamercurol-3-one, BENZOIC ACID, MERCURY COMPLEX, Mercury, (benzoato(2-)-C2,O1)-, MERCURY, (BENZOATO(2-)-.KAPPA.C2,.KAPPA.O1)-, O-(HYDROXYMERCURI)BENZOIC ACID, CYCLIC ANHYDRIDE
| Molecular Formula | C7H4HgO2 |
|---|---|
| Molecular Weight | 321.99 g/mol |
| LogP | 0.4294 |
| Topological Polar Surface Area | 36.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 321.99176 |
| Heavy Atoms | 10 |
| Complexity | 257.53796 |
Chemical Identifiers
| CAS Number | 5722-59-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)[O])[Hg] |
Product Overview
3H-2,1-Benzoxamercurol-3-one (CAS 5722-59-8), with molecular formula C7H4HgO2 and molecular weight 321.99 g/mol.
Chemical Property Profile of 3H-2,1-Benzoxamercurol-3-one
Property Insights of 3H-2,1-Benzoxamercurol-3-one
The XLogP value of 0.4294 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-2,1-Benzoxamercurol-3-one. With a topological polar surface area (TPSA) of 36.97 Ų, 3H-2,1-Benzoxamercurol-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-2,1-Benzoxamercurol-3-one has 0 hydrogen bond donor(s) and 1 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 3H-2,1-Benzoxamercurol-3-one?
The CAS number of 3H-2,1-Benzoxamercurol-3-one is 5722-59-8.
What is the molecular formula of 3H-2,1-Benzoxamercurol-3-one?
The molecular formula of 3H-2,1-Benzoxamercurol-3-one is C7H4HgO2.
What is the molecular weight of 3H-2,1-Benzoxamercurol-3-one?
The molecular weight of 3H-2,1-Benzoxamercurol-3-one is 321.99 g/mol.
Where can I buy 3H-2,1-Benzoxamercurol-3-one?
You can request a quote for 3H-2,1-Benzoxamercurol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-2,1-Benzoxamercurol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 3H-2,1-Benzoxamercurol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.