3-Acetyl-5-methyloxolan-2-one
TL;DR: 3-Acetyl-5-methyloxolan-2-one (CAS 3620-18-6) is a chemical compound with molecular formula C7H10O3 and molecular weight 142.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetyl-5-methyloxolan-2-one
Also Known As: 3-acetyl-5-methyloxolan-2-one, starbld0022836, 3-acetyl-5-methyldihydrofuran-2(3h)-one, 3-Acetyldihydro-5-methylfuran-2(3H)-one, 2(3H)-Furanone,3-acetyldihydro-5-methyl-
| Molecular Formula | C7H10O3 |
|---|---|
| Molecular Weight | 142.06 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 142.06299 |
| Heavy Atoms | 10 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 3620-18-6 |
|---|---|
| SMILES | CC1CC(C(=O)O1)C(=O)C |
| InChIKey | PNRIRUUSCZDXEP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Acetyl-5-methyloxolan-2-one (CAS 3620-18-6), with molecular formula C7H10O3 and molecular weight 142.06 g/mol. IUPAC: 3-acetyl-5-methyloxolan-2-one.
Chemical Property Profile of 3-Acetyl-5-methyloxolan-2-one
Property Insights of 3-Acetyl-5-methyloxolan-2-one
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetyl-5-methyloxolan-2-one. With a topological polar surface area (TPSA) of 43.4 Ų, 3-Acetyl-5-methyloxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetyl-5-methyloxolan-2-one 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 3-Acetyl-5-methyloxolan-2-one?
The CAS number of 3-Acetyl-5-methyloxolan-2-one is 3620-18-6.
What is the molecular formula of 3-Acetyl-5-methyloxolan-2-one?
The molecular formula of 3-Acetyl-5-methyloxolan-2-one is C7H10O3.
What is the molecular weight of 3-Acetyl-5-methyloxolan-2-one?
The molecular weight of 3-Acetyl-5-methyloxolan-2-one is 142.06 g/mol.
Where can I buy 3-Acetyl-5-methyloxolan-2-one?
You can request a quote for 3-Acetyl-5-methyloxolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetyl-5-methyloxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetyl-5-methyloxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.