![1,5-Dithia-spiro[5.5]undecan-7-one structure](/static/products/513/51310-03-3.png)
1,5-Dithia-spiro[5.5]undecan-7-one
TL;DR: 1,5-Dithia-spiro[5.5]undecan-7-one (CAS 51310-03-3) is a chemical compound with molecular formula C9H14OS2 and molecular weight 202.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dithiaspiro[5.5]undecan-11-one
Also Known As: 1,5-Dithia-spiro[5.5]undecan-7-one, 1,5-Dithiaspiro[5.5]undecan-7-one, 7,11-dithiaspiro[5.5]undecan-5-one
| Molecular Formula | C9H14OS2 |
|---|---|
| Molecular Weight | 202.05 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 67.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 202.04861 |
| Heavy Atoms | 12 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 51310-03-3 |
|---|---|
| SMILES | C1CCC2(C(=O)C1)SCCCS2 |
| InChIKey | SPPROIKVDXPQCQ-UHFFFAOYSA-N |
Product Overview
1,5-Dithia-spiro[5.5]undecan-7-one (CAS 51310-03-3), with molecular formula C9H14OS2 and molecular weight 202.05 g/mol. IUPAC: 1,5-dithiaspiro[5.5]undecan-11-one.
Chemical Property Profile of 1,5-Dithia-spiro[5.5]undecan-7-one
Property Insights of 1,5-Dithia-spiro[5.5]undecan-7-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-Dithia-spiro[5.5]undecan-7-one. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,5-Dithia-spiro[5.5]undecan-7-one. Following Lipinski's Rule of Five, 1,5-Dithia-spiro[5.5]undecan-7-one 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 1,5-Dithia-spiro[5.5]undecan-7-one?
The CAS number of 1,5-Dithia-spiro[5.5]undecan-7-one is 51310-03-3.
What is the molecular formula of 1,5-Dithia-spiro[5.5]undecan-7-one?
The molecular formula of 1,5-Dithia-spiro[5.5]undecan-7-one is C9H14OS2.
What is the molecular weight of 1,5-Dithia-spiro[5.5]undecan-7-one?
The molecular weight of 1,5-Dithia-spiro[5.5]undecan-7-one is 202.05 g/mol.
Where can I buy 1,5-Dithia-spiro[5.5]undecan-7-one?
You can request a quote for 1,5-Dithia-spiro[5.5]undecan-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dithia-spiro[5.5]undecan-7-one?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dithia-spiro[5.5]undecan-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.