2-苯基-1,3-二硫杂环戊烷1-氧化物
TL;DR: 2-苯基-1,3-二硫杂环戊烷1-氧化物 (CAS 89004-04-6) is a chemical compound with molecular formula C9H10OS2 and molecular weight 198.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-苯基-1,3-二硫杂环戊烷1-氧化物
2-phenyl-1,3-dithiolane 1-oxide
Also Known As: 2-Phenyl-1,3-dithiolane 1-oxide, 1,3-DITHIOLANE, 2-PHENYL-, 1-OXIDE, 2-phenyl-[1,3]dithiolane 1-oxide, 2-phenyl-1,3-dithiolan-1-ium-1-olate, 2-Phenyl-1,3lambda~4~-dithiolan-1-one
| Molecular Formula | C9H10OS2 |
|---|---|
| Molecular Weight | 198.02 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.0173 |
| Heavy Atoms | 12 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 89004-04-6 |
|---|---|
| SMILES | C1CS(=O)C(S1)C2=CC=CC=C2 |
| InChIKey | IWWRMSOVOAHAGD-UHFFFAOYSA-N |
Product Overview
2-苯基-1,3-二硫杂环戊烷1-氧化物 (CAS 89004-04-6), with molecular formula C9H10OS2 and molecular weight 198.02 g/mol. IUPAC: 2-phenyl-1,3-dithiolane 1-oxide.
Chemical Property Profile of 2-苯基-1,3-二硫杂环戊烷1-氧化物
Property Insights of 2-苯基-1,3-二硫杂环戊烷1-氧化物
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-苯基-1,3-二硫杂环戊烷1-氧化物. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-苯基-1,3-二硫杂环戊烷1-氧化物. Following Lipinski's Rule of Five, 2-苯基-1,3-二硫杂环戊烷1-氧化物 has 0 hydrogen bond donor(s) and 3 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-苯基-1,3-二硫杂环戊烷1-氧化物?
The CAS number of 2-苯基-1,3-二硫杂环戊烷1-氧化物 is 89004-04-6.
What is the molecular formula of 2-苯基-1,3-二硫杂环戊烷1-氧化物?
The molecular formula of 2-苯基-1,3-二硫杂环戊烷1-氧化物 is C9H10OS2.
What is the molecular weight of 2-苯基-1,3-二硫杂环戊烷1-氧化物?
The molecular weight of 2-苯基-1,3-二硫杂环戊烷1-氧化物 is 198.02 g/mol.
Where can I buy 2-苯基-1,3-二硫杂环戊烷1-氧化物?
You can request a quote for 2-苯基-1,3-二硫杂环戊烷1-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 2-苯基-1,3-二硫杂环戊烷1-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 2-苯基-1,3-二硫杂环戊烷1-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.