3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物
TL;DR: 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物 (CAS 84451-42-3) is a chemical compound with molecular formula C6H8O2S and molecular weight 144.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物
3λ6-thiabicyclo[3.2.0]hept-6-ene 3,3-dioxide
Also Known As: o-nitrotellurophenetole, 3-Thiabicyclo(3.2.0)hept-6-ene 3,3-dioxide, 3-thia-bicyclo[3.2.0]hept-6-ene 3,3-dioxide, 3-Thiabicyclo[3.2.0]hept-6-ene 3,3-dioxide, 3-Thiabicyclo[3.2.0]hept-6-ene,3,3-dioxide
| Molecular Formula | C6H8O2S |
|---|---|
| Molecular Weight | 144.02 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.0245 |
| Heavy Atoms | 9 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 84451-42-3 |
|---|---|
| SMILES | C1C2C=CC2CS1(=O)=O |
| InChIKey | AOTYWRMIFZIYNX-UHFFFAOYSA-N |
Product Overview
3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物 (CAS 84451-42-3), with molecular formula C6H8O2S and molecular weight 144.02 g/mol. IUPAC: 3λ6-thiabicyclo[3.2.0]hept-6-ene 3,3-dioxide.
Chemical Property Profile of 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物
Property Insights of 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物. With a topological polar surface area (TPSA) of 42.5 Ų, 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物 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 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物?
The CAS number of 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物 is 84451-42-3.
What is the molecular formula of 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物?
The molecular formula of 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物 is C6H8O2S.
What is the molecular weight of 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物?
The molecular weight of 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物 is 144.02 g/mol.
Where can I buy 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物?
You can request a quote for 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物?
Yes, KEHONG BIO provides custom synthesis services for 3-硫杂双环(3.2.0)庚-6-烯3,3-二氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.