2-(1,3-二硫杂环戊烷-2-基)环庚酮
TL;DR: 2-(1,3-二硫杂环戊烷-2-基)环庚酮 (CAS 51717-64-7) is a chemical compound with molecular formula C10H16OS2 and molecular weight 216.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-二硫杂环戊烷-2-基)环庚酮
2-(1,3-dithiolan-2-yl)cycloheptan-1-one
Also Known As: 2-(1,3-Dithiolan-2-yl)cycloheptanone, 2-(1,3-dithiolan-2-yl)cycloheptan-1-one, CYCLOHEPTANONE, 2-(1,3-DITHIOLAN-2-YL)-, RefChem:1082453
| Molecular Formula | C10H16OS2 |
|---|---|
| Molecular Weight | 216.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 67.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.06425 |
| Heavy Atoms | 13 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 51717-64-7 |
|---|---|
| SMILES | C1CCC(C(=O)CC1)C2SCCS2 |
| InChIKey | ITIKPJFUKFUPSF-UHFFFAOYSA-N |
Product Overview
2-(1,3-二硫杂环戊烷-2-基)环庚酮 (CAS 51717-64-7), with molecular formula C10H16OS2 and molecular weight 216.06 g/mol. IUPAC: 2-(1,3-dithiolan-2-yl)cycloheptan-1-one.
Chemical Property Profile of 2-(1,3-二硫杂环戊烷-2-基)环庚酮
Property Insights of 2-(1,3-二硫杂环戊烷-2-基)环庚酮
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-二硫杂环戊烷-2-基)环庚酮. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-二硫杂环戊烷-2-基)环庚酮. Following Lipinski's Rule of Five, 2-(1,3-二硫杂环戊烷-2-基)环庚酮 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-(1,3-二硫杂环戊烷-2-基)环庚酮?
The CAS number of 2-(1,3-二硫杂环戊烷-2-基)环庚酮 is 51717-64-7.
What is the molecular formula of 2-(1,3-二硫杂环戊烷-2-基)环庚酮?
The molecular formula of 2-(1,3-二硫杂环戊烷-2-基)环庚酮 is C10H16OS2.
What is the molecular weight of 2-(1,3-二硫杂环戊烷-2-基)环庚酮?
The molecular weight of 2-(1,3-二硫杂环戊烷-2-基)环庚酮 is 216.06 g/mol.
Where can I buy 2-(1,3-二硫杂环戊烷-2-基)环庚酮?
You can request a quote for 2-(1,3-二硫杂环戊烷-2-基)环庚酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-二硫杂环戊烷-2-基)环庚酮?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-二硫杂环戊烷-2-基)环庚酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.