4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl-
TL;DR: 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl- (CAS 54458-60-5) is a chemical compound with molecular formula C9H16O2 and molecular weight 156.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,5,6-tetramethyloxan-4-one
Also Known As: 2,3,5,6-tetramethyloxan-4-one, 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl-, 2,3,5,6-tetramethyl-4-pyranone, J1.835.678C, 2,3,5,6-Tetramethyltetrahydro-4H-pyran-4-one
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 156.11504 |
| Heavy Atoms | 11 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 54458-60-5 |
|---|---|
| SMILES | CC1C(OC(C(C1=O)C)C)C |
| InChIKey | OLRWZIXENFRUMK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl- (CAS 54458-60-5), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: 2,3,5,6-tetramethyloxan-4-one.
Chemical Property Profile of 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl-
Property Insights of 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl-. With a topological polar surface area (TPSA) of 26.3 Ų, 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl- 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, tetrahydro-2,3,5,6-tetramethyl-?
The CAS number of 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl- is 54458-60-5.
What is the molecular formula of 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl-?
The molecular formula of 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl- is C9H16O2.
What is the molecular weight of 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl-?
The molecular weight of 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl- is 156.12 g/mol.
Where can I buy 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl-?
You can request a quote for 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl- 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, tetrahydro-2,3,5,6-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for 4H-Pyran-4-one, tetrahydro-2,3,5,6-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.