2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione
TL;DR: 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione (CAS 130727-98-9) is a chemical compound with molecular formula C11H7BrO2S2 and molecular weight 313.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1,3-dithiophen-2-ylpropane-1,3-dione
Also Known As: bromodi-2-thenoylmethane, 2-bromo-1,3-dithiophen-2-ylpropane-1,3-dione, 2-bromo-1,3-dithiophen-2-yl-propane-1,3-dione, 2-BROMO-1,3-DI-THIOPHEN-2-YL-PROPANE-1,3-DIONE
| Molecular Formula | C11H7BrO2S2 |
|---|---|
| Molecular Weight | 313.91 g/mol |
| LogP | 3.6387 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 313.90707 |
| Heavy Atoms | 16 |
| Complexity | 441.80145 |
Chemical Identifiers
| CAS Number | 130727-98-9 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)C(C(=O)C2=CC=CS2)Br |
Product Overview
2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione (CAS 130727-98-9), with molecular formula C11H7BrO2S2 and molecular weight 313.91 g/mol. IUPAC: 2-bromo-1,3-dithiophen-2-ylpropane-1,3-dione.
Chemical Property Profile of 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione
Property Insights of 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione
The XLogP value of 3.6387 indicates that 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-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 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione?
The CAS number of 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione is 130727-98-9.
What is the molecular formula of 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione?
The molecular formula of 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione is C11H7BrO2S2.
What is the molecular weight of 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione?
The molecular weight of 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione is 313.91 g/mol.
Where can I buy 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione?
You can request a quote for 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1,3-DI-thiophen-2-YL-propane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.