Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate
TL;DR: Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate (CAS 7470-47-5) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 2,4-dimethyl-6-oxopyran-3-carboxylate
Also Known As: propyl 2,4-dimethyl-6-oxopyran-3-carboxylate, PROPYL 2,4-DIMETHYL-6-OXO-PYRAN-3-CARBOXYLATE, propyl 4,6-dimethyl-2-oxo-2H-pyran-5-carboxylate, propyl 4,6-dimethyl-2-oxopyran-5-carboxylate
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 7470-47-5 |
|---|---|
| SMILES | CCCOC(=O)C1=C(OC(=O)C=C1C)C |
| InChIKey | QRUNYUVTFYIPPQ-UHFFFAOYSA-N |
Product Overview
Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate (CAS 7470-47-5), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: propyl 2,4-dimethyl-6-oxopyran-3-carboxylate.
Chemical Property Profile of Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate
Property Insights of Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate 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 Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate?
The CAS number of Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate is 7470-47-5.
What is the molecular formula of Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate?
The molecular formula of Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate is C11H14O4.
What is the molecular weight of Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate?
The molecular weight of Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate is 210.09 g/mol.
Where can I buy Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate?
You can request a quote for Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 2,4-dimethyl-6-oxo-pyran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.