![Spiro[3.3]heptane-2,6-dione structure](/static/products/2006/20061-23-8.webp)
Spiro[3.3]heptane-2,6-dione
TL;DR: Spiro[3.3]heptane-2,6-dione (CAS 20061-23-8) is a chemical compound with molecular formula C7H8O2 and molecular weight 124.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
spiro[3.3]heptane-2,6-dione
Also Known As: Spiro[3.3]heptane-2,6-dione, Spiro(3.3)heptane-2,6-dione, RefChem:380859
| Molecular Formula | C7H8O2 |
|---|---|
| Molecular Weight | 124.05 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 124.05243 |
| Heavy Atoms | 9 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 20061-23-8 |
|---|---|
| SMILES | C1C(=O)CC12CC(=O)C2 |
| InChIKey | SPMIAKLTMJWZDX-UHFFFAOYSA-N |
Product Overview
Spiro[3.3]heptane-2,6-dione (CAS 20061-23-8), with molecular formula C7H8O2 and molecular weight 124.05 g/mol. IUPAC: spiro[3.3]heptane-2,6-dione.
Chemical Property Profile of Spiro[3.3]heptane-2,6-dione
Property Insights of Spiro[3.3]heptane-2,6-dione
The XLogP value of -0.8 indicates that Spiro[3.3]heptane-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.1 Ų, Spiro[3.3]heptane-2,6-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Spiro[3.3]heptane-2,6-dione 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 Spiro[3.3]heptane-2,6-dione?
The CAS number of Spiro[3.3]heptane-2,6-dione is 20061-23-8.
What is the molecular formula of Spiro[3.3]heptane-2,6-dione?
The molecular formula of Spiro[3.3]heptane-2,6-dione is C7H8O2.
What is the molecular weight of Spiro[3.3]heptane-2,6-dione?
The molecular weight of Spiro[3.3]heptane-2,6-dione is 124.05 g/mol.
Where can I buy Spiro[3.3]heptane-2,6-dione?
You can request a quote for Spiro[3.3]heptane-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spiro[3.3]heptane-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for Spiro[3.3]heptane-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.