2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione
TL;DR: 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione (CAS 52819-09-7) is a chemical compound with molecular formula C4H3Cl3O2S and molecular weight 219.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,3-trichloro-2H-thiophene 1,1-dioxide
Also Known As: 2,3,3-trichloro-2H-thiophene 1,1-dioxide, 3,3,4-Trichloro-2,3-dihydrothiophene 1,1-dioxide, Thiophene, 2,3-dihydro-3,3,4-trichloro-, 1,1-dioxide, 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione
| Molecular Formula | C4H3Cl3O2S |
|---|---|
| Molecular Weight | 219.89 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 219.89194 |
| Heavy Atoms | 10 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 52819-09-7 |
|---|---|
| SMILES | C1=CS(=O)(=O)C(C1(Cl)Cl)Cl |
| InChIKey | QWUODKBQPUMHCL-UHFFFAOYSA-N |
Product Overview
2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione (CAS 52819-09-7), with molecular formula C4H3Cl3O2S and molecular weight 219.89 g/mol. IUPAC: 2,3,3-trichloro-2H-thiophene 1,1-dioxide.
Chemical Property Profile of 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione
Property Insights of 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione. With a topological polar surface area (TPSA) of 42.5 Ų, 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione 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 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione?
The CAS number of 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione is 52819-09-7.
What is the molecular formula of 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione?
The molecular formula of 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione is C4H3Cl3O2S.
What is the molecular weight of 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione?
The molecular weight of 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione is 219.89 g/mol.
Where can I buy 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione?
You can request a quote for 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,3,3-Trichloro-2,3-dihydro-1H-1lambda~6~-thiophene-1,1-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.