2,5-di(propan-2-ylidene)thiophene 1,1-dioxide
TL;DR: 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide (CAS 17113-41-6) is a chemical compound with molecular formula C10H14O2S and molecular weight 198.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-di(propan-2-ylidene)thiophene 1,1-dioxide
Also Known As: 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide, 2,5-bis(methylethylidene)thiolene-1,1-dione, 2,5-dipropan-2-ylidenethiophene 1,1-dioxide, Thiophene, 2,5-dihydro-2,5-bis(1-methylethylidene)-, 1,1-dioxide, 2,5-Diisopropyliden-2,5-dihydro-thiophen-1,1-dioxid
| Molecular Formula | C10H14O2S |
|---|---|
| Molecular Weight | 198.07 g/mol |
| LogP | 2.5588 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.07146 |
| Heavy Atoms | 13 |
| Complexity | 377.8411 |
Chemical Identifiers
| CAS Number | 17113-41-6 |
|---|---|
| SMILES | CC(=C1C=CC(=C(C)C)S1(=O)=O)C |
Product Overview
2,5-di(propan-2-ylidene)thiophene 1,1-dioxide (CAS 17113-41-6), with molecular formula C10H14O2S and molecular weight 198.07 g/mol. IUPAC: 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide.
Chemical Property Profile of 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide
Property Insights of 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide
The XLogP value of 2.5588 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide. With a topological polar surface area (TPSA) of 34.14 Ų, 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide 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 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide?
The CAS number of 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide is 17113-41-6.
What is the molecular formula of 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide?
The molecular formula of 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide is C10H14O2S.
What is the molecular weight of 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide?
The molecular weight of 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide is 198.07 g/mol.
Where can I buy 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide?
You can request a quote for 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 2,5-di(propan-2-ylidene)thiophene 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.