2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate
TL;DR: 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate (CAS 869080-74-0) is a chemical compound with molecular formula C16H12O5S and molecular weight 316.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxo-3-phenylchromen-7-yl) methanesulfonate
Also Known As: 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate, (2-oxo-3-phenylchromen-7-yl) methanesulfonate, 2-oxo-3-phenylchromen-7-yl methylsulfonate, AB01332347-02, F1862-0569
| Molecular Formula | C16H12O5S |
|---|---|
| Molecular Weight | 316.04 g/mol |
| LogP | 2.7984 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.04056 |
| Heavy Atoms | 22 |
| Complexity | 987.97 |
Chemical Identifiers
| CAS Number | 869080-74-0 |
|---|---|
| SMILES | CS(=O)(=O)OC1=CC2=C(C=C1)C=C(C(=O)O2)C3=CC=CC=C3 |
Product Overview
2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate (CAS 869080-74-0), with molecular formula C16H12O5S and molecular weight 316.04 g/mol. IUPAC: (2-oxo-3-phenylchromen-7-yl) methanesulfonate.
Chemical Property Profile of 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate
Property Insights of 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate
The XLogP value of 2.7984 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate. Following Lipinski's Rule of Five, 2-oxo-3-phenyl-2H-chromen-7-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-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate?
The CAS number of 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate is 869080-74-0.
What is the molecular formula of 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate?
The molecular formula of 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate is C16H12O5S.
What is the molecular weight of 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate?
The molecular weight of 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate is 316.04 g/mol.
Where can I buy 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate?
You can request a quote for 2-oxo-3-phenyl-2H-chromen-7-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-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-oxo-3-phenyl-2H-chromen-7-yl methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.