2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-
TL;DR: 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis- (CAS 55013-32-6) 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.
(4R,5R)-5-butyl-4-methyloxolan-2-one
Also Known As: cis-Oaklactone, cis-Whiskey lactone, cis-Methyloctanolide, cis-3-Methyl-4-octanolide, Whiskey lactone
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 156.11504 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 55013-32-6 |
|---|---|
| SMILES | CCCC[C@@H]1[C@@H](CC(=O)O1)C |
| InChIKey | WNVCMFHPRIBNCW-HTQZYQBOSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis- (CAS 55013-32-6), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: (4R,5R)-5-butyl-4-methyloxolan-2-one.
Chemical Property Profile of 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-
Property Insights of 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-. With a topological polar surface area (TPSA) of 26.3 Ų, 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis- 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 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-?
The CAS number of 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis- is 55013-32-6.
What is the molecular formula of 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-?
The molecular formula of 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis- is C9H16O2.
What is the molecular weight of 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-?
The molecular weight of 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis- is 156.12 g/mol.
Where can I buy 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-?
You can request a quote for 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis-?
Yes, KEHONG BIO provides custom synthesis services for 2(3H)-Furanone, 5-butyldihydro-4-methyl-, cis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.