![1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one structure](/static/products/7687/7687-79-8.webp)
1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one
TL;DR: 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one (CAS 7687-79-8) is a chemical compound with molecular formula C7H4Cl2OS and molecular weight 205.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dichloro-5,6-dihydrocyclopenta[c]thiophen-4-one
Also Known As: 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one, 1,3-dichloro-5,6-dihydrocyclopenta[c]thiophen-4-one, 1,3-Dichloro-5,6-dihydro-4H-cyclopenta(c)thiophen-4-one, 4-Oxo-1,3-dichlor-cyclopenta
| Molecular Formula | C7H4Cl2OS |
|---|---|
| Molecular Weight | 205.94 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 205.93599 |
| Heavy Atoms | 11 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 7687-79-8 |
|---|---|
| SMILES | C1CC(=O)C2=C(SC(=C21)Cl)Cl |
| InChIKey | MESRLDSDCXYQMB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one (CAS 7687-79-8), with molecular formula C7H4Cl2OS and molecular weight 205.94 g/mol. IUPAC: 1,3-dichloro-5,6-dihydrocyclopenta[c]thiophen-4-one.
Chemical Property Profile of 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one
Property Insights of 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one
The XLogP value of 3.3 indicates that 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.3 Ų, 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one has 0 hydrogen bond donor(s) and 2 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 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one?
The CAS number of 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one is 7687-79-8.
What is the molecular formula of 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one?
The molecular formula of 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one is C7H4Cl2OS.
What is the molecular weight of 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one?
The molecular weight of 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one is 205.94 g/mol.
Where can I buy 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one?
You can request a quote for 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dichloro-5,6-dihydro-4H-cyclopenta[c]thiophen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.