1,4-Dioxaspiro(4.6)undecan-6-one
TL;DR: 1,4-Dioxaspiro(4.6)undecan-6-one (CAS 89874-32-8) is a chemical compound with molecular formula C9H14O3 and molecular weight 170.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dioxaspiro[4.6]undecan-6-one
Also Known As: 1,4-Dioxaspiro[4.6]undecan-6-one, 2,2-dimethoxycycloheptanone, 1,4-Dioxaspiro(4.6)undecan-6-one, 1,4-dioxaspiro[4.6]undecan-11-one, RefChem:220790
| Molecular Formula | C9H14O3 |
|---|---|
| Molecular Weight | 170.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 170.0943 |
| Heavy Atoms | 12 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 89874-32-8 |
|---|---|
| SMILES | C1CCC(=O)C2(CC1)OCCO2 |
| InChIKey | ZICAMABFFYFUNV-UHFFFAOYSA-N |
Product Overview
1,4-Dioxaspiro(4.6)undecan-6-one (CAS 89874-32-8), with molecular formula C9H14O3 and molecular weight 170.09 g/mol. IUPAC: 1,4-dioxaspiro[4.6]undecan-6-one.
Chemical Property Profile of 1,4-Dioxaspiro(4.6)undecan-6-one
Property Insights of 1,4-Dioxaspiro(4.6)undecan-6-one
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dioxaspiro(4.6)undecan-6-one. With a topological polar surface area (TPSA) of 35.5 Ų, 1,4-Dioxaspiro(4.6)undecan-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dioxaspiro(4.6)undecan-6-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 1,4-Dioxaspiro(4.6)undecan-6-one?
The CAS number of 1,4-Dioxaspiro(4.6)undecan-6-one is 89874-32-8.
What is the molecular formula of 1,4-Dioxaspiro(4.6)undecan-6-one?
The molecular formula of 1,4-Dioxaspiro(4.6)undecan-6-one is C9H14O3.
What is the molecular weight of 1,4-Dioxaspiro(4.6)undecan-6-one?
The molecular weight of 1,4-Dioxaspiro(4.6)undecan-6-one is 170.09 g/mol.
Where can I buy 1,4-Dioxaspiro(4.6)undecan-6-one?
You can request a quote for 1,4-Dioxaspiro(4.6)undecan-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dioxaspiro(4.6)undecan-6-one?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dioxaspiro(4.6)undecan-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.