![2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione structure](/static/products/7794/77944-07-1.webp)
2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione
TL;DR: 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione (CAS 77944-07-1) is a chemical compound with molecular formula C9H10Cl2O4 and molecular weight 252.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,8-bis(chloromethyl)-2,7-dioxaspiro[4.4]nonane-1,6-dione
Also Known As: 2,7-bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione, 3,8-bis(chloromethyl)-2,7-dioxaspiro[4.4]nonane-1,6-dione
| Molecular Formula | C9H10Cl2O4 |
|---|---|
| Molecular Weight | 252.00 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.99562 |
| Heavy Atoms | 15 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 77944-07-1 |
|---|---|
| SMILES | C1C(OC(=O)C12CC(OC2=O)CCl)CCl |
| InChIKey | HWZHLKQPHKYGQI-UHFFFAOYSA-N |
Product Overview
2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione (CAS 77944-07-1), with molecular formula C9H10Cl2O4 and molecular weight 252.00 g/mol. IUPAC: 3,8-bis(chloromethyl)-2,7-dioxaspiro[4.4]nonane-1,6-dione.
Chemical Property Profile of 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione
Property Insights of 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione. With a topological polar surface area (TPSA) of 52.6 Ų, 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione has 0 hydrogen bond donor(s) and 4 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 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione?
The CAS number of 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione is 77944-07-1.
What is the molecular formula of 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione?
The molecular formula of 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione is C9H10Cl2O4.
What is the molecular weight of 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione?
The molecular weight of 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione is 252.00 g/mol.
Where can I buy 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione?
You can request a quote for 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,7-Bis(chloromethyl)-3,8-dioxaspiro[4.4]nonane-4,9-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.