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Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-
TL;DR: Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro- (CAS 62338-05-0) is a chemical compound with molecular formula C8H12S2 and molecular weight 172.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,10-dithiatricyclo[5.3.0.02,6]decane
Also Known As: Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-, 3,10-dithiatricyclo[5.3.0.02,6]decane, Octahydrocyclobuta[1,2-b:4,3-b']dithiophene, Octahydrocyclobuta[1,2-b:4,3-b ]dithiophene
| Molecular Formula | C8H12S2 |
|---|---|
| Molecular Weight | 172.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.03804 |
| Heavy Atoms | 10 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 62338-05-0 |
|---|---|
| SMILES | C1CSC2C1C3C2SCC3 |
| InChIKey | OATXHBKHSKZDGF-UHFFFAOYSA-N |
Product Overview
Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro- (CAS 62338-05-0), with molecular formula C8H12S2 and molecular weight 172.04 g/mol. IUPAC: 3,10-dithiatricyclo[5.3.0.02,6]decane.
Chemical Property Profile of Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-
Property Insights of Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-. With a topological polar surface area (TPSA) of 50.6 Ų, Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro- 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 Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-?
The CAS number of Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro- is 62338-05-0.
What is the molecular formula of Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-?
The molecular formula of Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro- is C8H12S2.
What is the molecular weight of Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-?
The molecular weight of Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro- is 172.04 g/mol.
Where can I buy Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-?
You can request a quote for Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro-?
Yes, KEHONG BIO provides custom synthesis services for Cyclobuta[1,2-b:4,3-b']dithiophene, octahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.