3-Methylglutaric anhydride
TL;DR: 3-Methylglutaric anhydride (CAS 4166-53-4) 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.
4-methyloxane-2,6-dione
Also Known As: 3-Methylglutaric anhydride, 4-methyloxane-2,6-dione, strophanthidin, 4-Methyldihydro-2H-pyran-2,6(3H)-dione, 3-Methylglutaricanhydride
| Molecular Formula | C6H8O3 |
|---|---|
| Molecular Weight | 128.05 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.04735 |
| Heavy Atoms | 9 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 4166-53-4 |
|---|---|
| SMILES | CC1CC(=O)OC(=O)C1 |
| InChIKey | MGICRVTUCPFQQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methylglutaric anhydride (CAS 4166-53-4), with molecular formula C6H8O3 and molecular weight 128.05 g/mol. IUPAC: 4-methyloxane-2,6-dione.
Chemical Property Profile of 3-Methylglutaric anhydride
Property Insights of 3-Methylglutaric anhydride
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylglutaric anhydride. With a topological polar surface area (TPSA) of 43.4 Ų, 3-Methylglutaric anhydride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylglutaric anhydride 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 3-Methylglutaric anhydride?
The CAS number of 3-Methylglutaric anhydride is 4166-53-4.
What is the molecular formula of 3-Methylglutaric anhydride?
The molecular formula of 3-Methylglutaric anhydride is C6H8O3.
What is the molecular weight of 3-Methylglutaric anhydride?
The molecular weight of 3-Methylglutaric anhydride is 128.05 g/mol.
Where can I buy 3-Methylglutaric anhydride?
You can request a quote for 3-Methylglutaric anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylglutaric anhydride?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylglutaric anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.