Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate
TL;DR: Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate (CAS 10226-28-5) is a chemical compound with molecular formula C9H14O3 and molecular weight 170.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 6-methyl-3,4-dihydro-2H-pyran-5-carboxylate
Also Known As: Ethyl 6-methyl-3,4-dihydro-2H-pyran-5-carboxylate, 3-Ethoxycarbonyl-5,6-dihydro-2-methyl-4H-pyran, 2-Methyl-3-carbethoxy-5,6-dihydropyran, BWVSWJMSYLYIJA-UHFFFAOYSA-, 2H-Pyran-5-carboxylic acid, 3,4-dihydro-6-methyl-, ethyl ester
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H14O3 |
| Molecular Weight | 170.0943 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.0943 Da |
| Heavy Atoms | 12 |
| Complexity | 206.0 |
| SMILES | CCOC(=O)C1=C(OCCC1)C |
| InChIKey | BWVSWJMSYLYIJA-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate
Property Insights of Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate. With a topological polar surface area (TPSA) of 35.5 Ų, Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate 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
What is the CAS number of Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate?
The CAS number of Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate is 10226-28-5.
What is the molecular formula of Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate?
The molecular formula of Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate is C9H14O3.
What is the molecular weight of Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate?
The molecular weight of Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate is 170.0943 g/mol.
Where can I buy Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate?
You can request a quote for Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate?
Yes, CoreyChem provides custom synthesis services for Ethyl 3,4-dihydro-6-methyl-2H-pyran-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.