(2-Oxochromen-4-yl) methanesulfonate
TL;DR: (2-Oxochromen-4-yl) methanesulfonate (CAS 62113-90-0) is a chemical compound with molecular formula C10H8O5S and molecular weight 240.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxochromen-4-yl) methanesulfonate
Also Known As: 4-mesyloxycoumarin, (2-oxochromen-4-yl) methanesulfonate, 4-Methylsulfonyloxychromen-2-one, 2-Oxochromen-4-yl methanesulfonate, 2-Oxo-2H-1-benzopyran-4-yl methanesulfonate
| Molecular Formula | C10H8O5S |
|---|---|
| Molecular Weight | 240.01 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 78.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.00925 |
| Heavy Atoms | 16 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 62113-90-0 |
|---|---|
| SMILES | CS(=O)(=O)OC1=CC(=O)OC2=CC=CC=C21 |
| InChIKey | XUCIDHRPANPZOD-UHFFFAOYSA-N |
Product Overview
(2-Oxochromen-4-yl) methanesulfonate (CAS 62113-90-0), with molecular formula C10H8O5S and molecular weight 240.01 g/mol. IUPAC: (2-oxochromen-4-yl) methanesulfonate.
Chemical Property Profile of (2-Oxochromen-4-yl) methanesulfonate
Property Insights of (2-Oxochromen-4-yl) methanesulfonate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Oxochromen-4-yl) methanesulfonate. The TPSA of 78.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Oxochromen-4-yl) methanesulfonate. Following Lipinski's Rule of Five, (2-Oxochromen-4-yl) methanesulfonate has 0 hydrogen bond donor(s) and 5 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 (2-Oxochromen-4-yl) methanesulfonate?
The CAS number of (2-Oxochromen-4-yl) methanesulfonate is 62113-90-0.
What is the molecular formula of (2-Oxochromen-4-yl) methanesulfonate?
The molecular formula of (2-Oxochromen-4-yl) methanesulfonate is C10H8O5S.
What is the molecular weight of (2-Oxochromen-4-yl) methanesulfonate?
The molecular weight of (2-Oxochromen-4-yl) methanesulfonate is 240.01 g/mol.
Where can I buy (2-Oxochromen-4-yl) methanesulfonate?
You can request a quote for (2-Oxochromen-4-yl) methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Oxochromen-4-yl) methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (2-Oxochromen-4-yl) methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.