![1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- structure](/static/products/126/126091-80-3.png)
1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl-
TL;DR: 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- (CAS 126091-80-3) is a chemical compound with molecular formula C6H8O3 and molecular weight 128.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-1,4-dioxaspiro[2.4]heptan-5-one
Also Known As: 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl-, 4-methyl-2,7-dioxaspiro[2.4]heptan-6-one, 7-methyl-1,4-dioxaspiro(2.4)heptan-5-one, 7-methyl-1,4-dioxaspiro[2.4]heptan-5-one (non-preferred name)
| Molecular Formula | C6H8O3 |
|---|---|
| Molecular Weight | 128.05 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.04735 |
| Heavy Atoms | 9 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 126091-80-3 |
|---|---|
| SMILES | CC1CC(=O)OC12CO2 |
| InChIKey | CRDVOLPCGSIZKD-UHFFFAOYSA-N |
Product Overview
1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- (CAS 126091-80-3), with molecular formula C6H8O3 and molecular weight 128.05 g/mol. IUPAC: 7-methyl-1,4-dioxaspiro[2.4]heptan-5-one.
Chemical Property Profile of 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl-
Property Insights of 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl-. With a topological polar surface area (TPSA) of 38.8 Ų, 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- 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[2.4]heptan-5-one, 7-methyl-?
The CAS number of 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- is 126091-80-3.
What is the molecular formula of 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl-?
The molecular formula of 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- is C6H8O3.
What is the molecular weight of 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl-?
The molecular weight of 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- is 128.05 g/mol.
Where can I buy 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl-?
You can request a quote for 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- 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[2.4]heptan-5-one, 7-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dioxaspiro[2.4]heptan-5-one, 7-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.