Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate
TL;DR: Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate (CAS 38858-64-9) is a chemical compound with molecular formula C9H14O3 and molecular weight 170.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate
Also Known As: Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate, Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate #, 2H-Pyran-4-carboxylic acid, 3,4-dihydro-5-methyl-, ethyl ester, 3,4-Dihydro-5-methyl-2H-pyran-4-carboxylicacidethylester, 3,4-Dihydro-5-methyl-2H-pyran-4-carboxylic acid ethyl ester
| Molecular Formula | C9H14O3 |
|---|---|
| Molecular Weight | 170.09 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.0943 |
| Heavy Atoms | 12 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 38858-64-9 |
|---|---|
| SMILES | CCOC(=O)C1CCOC=C1C |
| InChIKey | XMUBMBVDGDQGHU-UHFFFAOYSA-N |
Product Overview
Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate (CAS 38858-64-9), with molecular formula C9H14O3 and molecular weight 170.09 g/mol. IUPAC: ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate.
Chemical Property Profile of Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate
Property Insights of Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate. With a topological polar surface area (TPSA) of 35.5 Ų, Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-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
Frequently Asked Questions
What is the CAS number of Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate?
The CAS number of Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate is 38858-64-9.
What is the molecular formula of Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate?
The molecular formula of Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate is C9H14O3.
What is the molecular weight of Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate?
The molecular weight of Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate is 170.09 g/mol.
Where can I buy Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate?
You can request a quote for Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-methyl-3,4-dihydro-2H-pyran-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.