2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro-
TL;DR: 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- (CAS 67770-79-0) is a chemical compound with molecular formula C11H20O2 and molecular weight 184.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butyl-5-ethyloxan-2-one
Also Known As: Ethyl butyl valerolactone, 5-butyl-5-ethyloxan-2-one, costus valerolactone, 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro-, 4-Ethyl-4-butyl-delta-valerolactone
| Molecular Formula | C11H20O2 |
|---|---|
| Molecular Weight | 184.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 184.14633 |
| Heavy Atoms | 13 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 67770-79-0 |
|---|---|
| SMILES | CCCCC1(CCC(=O)OC1)CC |
| InChIKey | BACWTVIXOCGZHC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- (CAS 67770-79-0), with molecular formula C11H20O2 and molecular weight 184.15 g/mol. IUPAC: 5-butyl-5-ethyloxan-2-one.
Chemical Property Profile of 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro-
Property Insights of 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro-
The XLogP value of 3.2 indicates that 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- 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 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro-?
The CAS number of 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- is 67770-79-0.
What is the molecular formula of 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro-?
The molecular formula of 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- is C11H20O2.
What is the molecular weight of 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro-?
The molecular weight of 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- is 184.15 g/mol.
Where can I buy 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro-?
You can request a quote for 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Pyran-2-one, 5-butyl-5-ethyltetrahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.