![1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate structure](/static/products/6126/6126-58-5.webp)
1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate
TL;DR: 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate (CAS 6126-58-5) is a chemical compound with molecular formula C13H22O4 and molecular weight 242.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,4-dioxaspiro[4.5]decan-6-yl)propan-2-yl acetate
Also Known As: KST-1B6272, 1-(1,4-dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate, 1-(1,4-dioxaspiro[4.5]decan-6-yl)propan-2-yl acetate, 1-(1,4-dioxaspiro[4.5]decan-10-yl)propan-2-yl acetate
| Molecular Formula | C13H22O4 |
|---|---|
| Molecular Weight | 242.15 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.15181 |
| Heavy Atoms | 17 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 6126-58-5 |
|---|---|
| SMILES | CC(CC1CCCCC12OCCO2)OC(=O)C |
| InChIKey | OEMBLKCCUXIBSK-UHFFFAOYSA-N |
Product Overview
1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate (CAS 6126-58-5), with molecular formula C13H22O4 and molecular weight 242.15 g/mol. IUPAC: 1-(1,4-dioxaspiro[4.5]decan-6-yl)propan-2-yl acetate.
Chemical Property Profile of 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate
Property Insights of 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate. With a topological polar surface area (TPSA) of 44.8 Ų, 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate 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 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate?
The CAS number of 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate is 6126-58-5.
What is the molecular formula of 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate?
The molecular formula of 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate is C13H22O4.
What is the molecular weight of 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate?
The molecular weight of 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate is 242.15 g/mol.
Where can I buy 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate?
You can request a quote for 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,4-Dioxaspiro[4.5]dec-6-yl)propan-2-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.