Lot numbers can be found on the outside label of a product:
Methyl 6-chlorobenzo[b]thiophene-2-carboxylate
-
CAS No. 104795-85-9
- Cat. No. CS-0150787
- Purity≥98%
- MDL No.MFCD09027103
*For research and further manufacturing use only, not for direct human use.
![Methyl 6-chlorobenzo[b]thiophene-2-carboxylate|CS-0150787](https://file.chemscene.com/productPIC/CS-0150787.gif)
Structure of 104795-85-9
Please choose your location and provide accurate information for you
| Size |
|
Price | Quantity | |||
|---|---|---|---|---|---|---|
|
* Please select Quantity before adding items. |
||||||
Recommended Products
General Information
- CAS No. 104795-85-9
- Cat. No. CS-0150787
- Purity ≥98%
- MDL No. MFCD09027103
- Storage Store at room temperature
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₀H₇ClO₂S
- Molecular Weight 226.68
- Synonym(s) Methyl 6-chloro-1-benzothiophene-2-carboxylate
- SMILES COC(=O)C1=CC2=C(C=C(C=C2)Cl)S1
Description
Methyl 6-chlorobenzo[b]thiophene-2-carboxylate is a bench-stable heterocyclic ester featuring a chlorine substituent at the 6-position, enhancing electrophilic reactivity. This electron-deficient scaffold integrates readily into cross-coupling and cyclization workflows, enabling efficient access to complex thiophene-based architectures in medicinal chemistry and materials synthesis.
Application
Methyl 6-chlorobenzo[b]thiophene-2-carboxylate serves as a versatile building block in medicinal chemistry and materials science, enabling direct functionalization at the 5-position via palladium-catalyzed cross-coupling reactions. The chloro substituent offers high stability under standard reaction conditions and facilitates orthogonal transformations. Its bench-stable nature and compatibility with diverse synthetic workflows make it ideal for constructing complex heterocyclic scaffolds found in pharmaceutical intermediates and optoelectronic materials.
Synthesis
-
Route1
-
In-stock
5551-11-1 -
2365-48-2 - ~83%
-
In-stock
104795-85-9
References
-
Faeh, Christoph; Kuehne, Holger; Luebbers, Thomas; Mattei, Patrizio; Maugeais, Cyrille; Pflieger, Philippe Patent: US2007/185113 A1, 2007 ; Location in patent: Page/Page column 13 ;
-
-
Route2
-
In-stock
61072-56-8 -
2365-48-2
- ~73%
-
In-stock
104795-85-9
References
-
Fedi, Valentina; Altamura, Maria; Catalioto, Rose-Marie; Giannotti, Danilo; Giolitti, Alessandro; Giuliani, Sandro; Guidi, Antonio; Harmat, Nicholas J. S.; Lecci, Alessandro; Meini, Stefania; Nannicini, Rossano; Pasqui, Franco; Tramontana, Manuela; Triolo, Antonio; Maggi, Carlo Alberto Journal of Medicinal Chemistry, 2007 , vol. 50, # 20 p. 4793 - 4807
-
-
Route3
-
67-56-1
-
201230-82-2
-
1301265-08-6
- ~45%
-
1322718-91-1
-
In-stock
104795-85-9
References
-
Organic Letters, , vol. 13, # 11 p. 2868 - 2871
-
Safety Information
Download SDS|
GHS Pictogram :
|
GHS No : GHS07
|
|
Signal Word : Warning
|
UN#: N/A
|
|
Class : N/A
|
Packing Group : N/A
|
|
Hazard Statements : H302
|
|
|
Precautionary Statements : P264-P270-P330-P501
|
|
Quality Control
Computational Chemistry Data
- TPSA 26.3
- LogP 3.3413
- H_Acceptors 3
- H_Donors 0
- Rotatable_Bonds 1
Similar Products
Other Classifications
Recently Viewed Products
Leave US a Message
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
Upload Pictures
|
|
Key Words
- 104795-85-9 sigma104795-85-9 manufacturer104795-85-9 price104795-85-9 structure104795-85-9 SDSbuy 104795-85-9104795-85-9 supplier104795-85-9 uses104795-85-9 molecular weightprice of 104795-85-9104795-85-9 chemical name formula of 104795-85-9