6-Methoxy-1-benzothiophene-2,3-dione
TL;DR: 6-Methoxy-1-benzothiophene-2,3-dione (CAS 63675-77-4) is a chemical compound with molecular formula C9H6O3S and molecular weight 194.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methoxy-1-benzothiophene-2,3-dione
Also Known As: 6-Methoxybenzo[b]thiophene-2,3-dione, 6-methoxy-1-benzothiophene-2,3-dione, 6-methoxy-2,3-dihydro-1-benzothiophene-2,3-dione, J1.920.968G, 6-methoxy-2,3-dioxo-2,3-dihydrobenzothiophene
| Molecular Formula | C9H6O3S |
|---|---|
| Molecular Weight | 194.00 g/mol |
| LogP | 1.5102 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.00377 |
| Heavy Atoms | 13 |
| Complexity | 397.84634 |
Chemical Identifiers
| CAS Number | 63675-77-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=O)C(=O)S2 |
Product Overview
6-Methoxy-1-benzothiophene-2,3-dione (CAS 63675-77-4), with molecular formula C9H6O3S and molecular weight 194.00 g/mol. IUPAC: 6-methoxy-1-benzothiophene-2,3-dione.
Chemical Property Profile of 6-Methoxy-1-benzothiophene-2,3-dione
Property Insights of 6-Methoxy-1-benzothiophene-2,3-dione
The XLogP value of 1.5102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methoxy-1-benzothiophene-2,3-dione. With a topological polar surface area (TPSA) of 43.37 Ų, 6-Methoxy-1-benzothiophene-2,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methoxy-1-benzothiophene-2,3-dione has 0 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 6-Methoxy-1-benzothiophene-2,3-dione?
The CAS number of 6-Methoxy-1-benzothiophene-2,3-dione is 63675-77-4.
What is the molecular formula of 6-Methoxy-1-benzothiophene-2,3-dione?
The molecular formula of 6-Methoxy-1-benzothiophene-2,3-dione is C9H6O3S.
What is the molecular weight of 6-Methoxy-1-benzothiophene-2,3-dione?
The molecular weight of 6-Methoxy-1-benzothiophene-2,3-dione is 194.00 g/mol.
Where can I buy 6-Methoxy-1-benzothiophene-2,3-dione?
You can request a quote for 6-Methoxy-1-benzothiophene-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxy-1-benzothiophene-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxy-1-benzothiophene-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.