(+-)-3-Methyl-2,4(3H,5H)-furandione
TL;DR: (+-)-3-Methyl-2,4(3H,5H)-furandione (CAS 69556-70-3) is a chemical compound with molecular formula C5H6O3 and molecular weight 114.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyloxolane-2,4-dione
Also Known As: 3-Methyl-furan-2,4-dione, methyl tetronate, 3-methyloxolane-2,4-dione, alpha-Methyltetronic acid, a-Methyltetronic acid
| Molecular Formula | C5H6O3 |
|---|---|
| Molecular Weight | 114.03 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 114.03169 |
| Heavy Atoms | 8 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 69556-70-3 |
|---|---|
| SMILES | CC1C(=O)COC1=O |
| InChIKey | AWGPWASAORSKKR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(+-)-3-Methyl-2,4(3H,5H)-furandione (CAS 69556-70-3), with molecular formula C5H6O3 and molecular weight 114.03 g/mol. IUPAC: 3-methyloxolane-2,4-dione.
Chemical Property Profile of (+-)-3-Methyl-2,4(3H,5H)-furandione
Property Insights of (+-)-3-Methyl-2,4(3H,5H)-furandione
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+-)-3-Methyl-2,4(3H,5H)-furandione. With a topological polar surface area (TPSA) of 43.4 Ų, (+-)-3-Methyl-2,4(3H,5H)-furandione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+-)-3-Methyl-2,4(3H,5H)-furandione 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-Methyl-2,4(3H,5H)-furandione?
The CAS number of (+-)-3-Methyl-2,4(3H,5H)-furandione is 69556-70-3.
What is the molecular formula of (+-)-3-Methyl-2,4(3H,5H)-furandione?
The molecular formula of (+-)-3-Methyl-2,4(3H,5H)-furandione is C5H6O3.
What is the molecular weight of (+-)-3-Methyl-2,4(3H,5H)-furandione?
The molecular weight of (+-)-3-Methyl-2,4(3H,5H)-furandione is 114.03 g/mol.
Where can I buy (+-)-3-Methyl-2,4(3H,5H)-furandione?
You can request a quote for (+-)-3-Methyl-2,4(3H,5H)-furandione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+-)-3-Methyl-2,4(3H,5H)-furandione?
Yes, KEHONG BIO provides custom synthesis services for (+-)-3-Methyl-2,4(3H,5H)-furandione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.