4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-
TL;DR: 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl- (CAS 18781-76-5) is a chemical compound with molecular formula C8H12O2 and molecular weight 140.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethyl-2-methyl-2,3-dihydropyran-4-one
Also Known As: 6-ethyl-2-methyl-2,3-dihydropyran-4-one, 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-, 2-Methyl-6-ethyl-2H-pyran-4(3H)-one, 6-Ethyl-2-methyl-2,3-dihydro-4H-pyran-4-one, J1.480.792F
| Molecular Formula | C8H12O2 |
|---|---|
| Molecular Weight | 140.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.08372 |
| Heavy Atoms | 10 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 18781-76-5 |
|---|---|
| SMILES | CCC1=CC(=O)CC(O1)C |
| InChIKey | NJADMLYOHSJLKV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl- (CAS 18781-76-5), with molecular formula C8H12O2 and molecular weight 140.08 g/mol. IUPAC: 6-ethyl-2-methyl-2,3-dihydropyran-4-one.
Chemical Property Profile of 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-
Property Insights of 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-. With a topological polar surface area (TPSA) of 26.3 Ų, 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl- has 0 hydrogen bond donor(s) and 2 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 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-?
The CAS number of 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl- is 18781-76-5.
What is the molecular formula of 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-?
The molecular formula of 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl- is C8H12O2.
What is the molecular weight of 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-?
The molecular weight of 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl- is 140.08 g/mol.
Where can I buy 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-?
You can request a quote for 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 4H-Pyran-4-one, 6-ethyl-2,3-dihydro-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.