3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride
TL;DR: 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride (CAS 137278-46-7) is a chemical compound with molecular formula C10H4Cl2O3S and molecular weight 273.9258 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-chlorothieno[2,3-f][1,3]benzodioxole-6-carbonyl chloride
Also Known As: 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride, 7-chlorothieno[2,3-f][1,3]benzodioxole-6-carbonyl chloride, Thieno[2,3-f]-1,3-benzodioxole-6-carbonyl chloride, 7-chloro-, 7-chlorothieno[2,3-f]-1,3-benzodioxole-6-carbonyl chloride, 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonylchloride
Technical Specifications
| Molecular Formula | C10H4Cl2O3S |
| Molecular Weight | 273.9258 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 63.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.9258 Da |
| Heavy Atoms | 16 |
| Complexity | 314.0 |
| SMILES | C1OC2=C(O1)C=C3C(=C2)C(=C(S3)C(=O)Cl)Cl |
| InChIKey | GSQHQQCOXOFRNW-UHFFFAOYSA-N |
Chemical Property Profile of 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride
Property Insights of 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride
The XLogP value of 4.2 indicates that 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride. Following Lipinski's Rule of Five, 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride 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
What is the CAS number of 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride?
The CAS number of 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride is 137278-46-7.
What is the molecular formula of 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride?
The molecular formula of 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride is C10H4Cl2O3S.
What is the molecular weight of 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride?
The molecular weight of 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride is 273.9258 g/mol.
Where can I buy 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride?
You can request a quote for 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride?
Yes, CoreyChem provides custom synthesis services for 3-Chloro-5,6-methylenedioxybenzothiophene-2-carbonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.