5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid
TL;DR: 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid (CAS 60299-47-0) is a chemical compound with molecular formula C9H10O6 and molecular weight 214.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-6-oxo-2H-pyran-4,5-dicarboxylic acid
Also Known As: 3,3-dimethyl-6-oxo-2H-pyran-4,5-dicarboxylic acid, 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid, 5,5-dimethyl-2-oxo-5,6-dihydro-2H-pyran-3,4-dicarboxylic acid
| Molecular Formula | C9H10O6 |
|---|---|
| Molecular Weight | 214.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.04774 |
| Heavy Atoms | 15 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 60299-47-0 |
|---|---|
| SMILES | CC1(COC(=O)C(=C1C(=O)O)C(=O)O)C |
| InChIKey | BUXRWSYJAHLHHN-UHFFFAOYSA-N |
Product Overview
5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid (CAS 60299-47-0), with molecular formula C9H10O6 and molecular weight 214.05 g/mol. IUPAC: 3,3-dimethyl-6-oxo-2H-pyran-4,5-dicarboxylic acid.
Chemical Property Profile of 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid
Property Insights of 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid. Following Lipinski's Rule of Five, 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid has 2 hydrogen bond donor(s) and 6 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 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid?
The CAS number of 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid is 60299-47-0.
What is the molecular formula of 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid?
The molecular formula of 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid is C9H10O6.
What is the molecular weight of 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid?
The molecular weight of 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid is 214.05 g/mol.
Where can I buy 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid?
You can request a quote for 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dihydro-5,5-dimethyl-2-oxo-2H-pyran-3,4-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.