3-Bromo-2-oxobornane-8-sulphonic acid
TL;DR: 3-Bromo-2-oxobornane-8-sulphonic acid (CAS 5344-58-1) is a chemical compound with molecular formula C10H15BrO4S and molecular weight 309.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-bromo-1,7-dimethyl-2-oxo-7-bicyclo[2.2.1]heptanyl)methanesulfonic acid
Also Known As: 3-Bromo-2-oxobornane-8-sulphonic acid, KST-1A8186, d-3-bro-mocamphor-8-sulfonic acid, 3-BROMO-2-OXO-8-BORNANESULFONIC ACID, [1R-(endo,anti)]-3-Bromo-2-oxobornane-8-sulphonic acid
| Molecular Formula | C10H15BrO4S |
|---|---|
| Molecular Weight | 309.99 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.98743 |
| Heavy Atoms | 16 |
| Complexity | 440.0 |
Chemical Identifiers
| CAS Number | 5344-58-1 |
|---|---|
| SMILES | CC12CCC(C1(C)CS(=O)(=O)O)C(C2=O)Br |
| InChIKey | MFEDKMBNKNOUPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Bromo-2-oxobornane-8-sulphonic acid (CAS 5344-58-1), with molecular formula C10H15BrO4S and molecular weight 309.99 g/mol. IUPAC: (3-bromo-1,7-dimethyl-2-oxo-7-bicyclo[2.2.1]heptanyl)methanesulfonic acid.
Chemical Property Profile of 3-Bromo-2-oxobornane-8-sulphonic acid
Property Insights of 3-Bromo-2-oxobornane-8-sulphonic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-2-oxobornane-8-sulphonic acid. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Bromo-2-oxobornane-8-sulphonic acid. Following Lipinski's Rule of Five, 3-Bromo-2-oxobornane-8-sulphonic acid 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 3-Bromo-2-oxobornane-8-sulphonic acid?
The CAS number of 3-Bromo-2-oxobornane-8-sulphonic acid is 5344-58-1.
What is the molecular formula of 3-Bromo-2-oxobornane-8-sulphonic acid?
The molecular formula of 3-Bromo-2-oxobornane-8-sulphonic acid is C10H15BrO4S.
What is the molecular weight of 3-Bromo-2-oxobornane-8-sulphonic acid?
The molecular weight of 3-Bromo-2-oxobornane-8-sulphonic acid is 309.99 g/mol.
Where can I buy 3-Bromo-2-oxobornane-8-sulphonic acid?
You can request a quote for 3-Bromo-2-oxobornane-8-sulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-2-oxobornane-8-sulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-2-oxobornane-8-sulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.