1-(5-Methyl-2-furanyl)-1,2-propanedione
TL;DR: 1-(5-Methyl-2-furanyl)-1,2-propanedione (CAS 1197-20-2) is a chemical compound with molecular formula C8H8O3 and molecular weight 152.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-methylfuran-2-yl)propane-1,2-dione
Also Known As: 1-(5-Methyl-2-furanyl)-1,2-propanedione, 1-(5-Methyl-2-furyl)propane-1,2-dione, 1-(5-methylfuran-2-yl)propane-1,2-dione, 1-(5-methyl-2-furyI)-1,2-propanedione, 1,2-Propanedione, 1-(5-methyl-2-furanyl)-
| Molecular Formula | C8H8O3 |
|---|---|
| Molecular Weight | 152.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.04735 |
| Heavy Atoms | 11 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 1197-20-2 |
|---|---|
| SMILES | CC1=CC=C(O1)C(=O)C(=O)C |
| InChIKey | CSILYJHAPLAXTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(5-Methyl-2-furanyl)-1,2-propanedione (CAS 1197-20-2), with molecular formula C8H8O3 and molecular weight 152.05 g/mol. IUPAC: 1-(5-methylfuran-2-yl)propane-1,2-dione.
Chemical Property Profile of 1-(5-Methyl-2-furanyl)-1,2-propanedione
Property Insights of 1-(5-Methyl-2-furanyl)-1,2-propanedione
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Methyl-2-furanyl)-1,2-propanedione. With a topological polar surface area (TPSA) of 47.3 Ų, 1-(5-Methyl-2-furanyl)-1,2-propanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Methyl-2-furanyl)-1,2-propanedione 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 1-(5-Methyl-2-furanyl)-1,2-propanedione?
The CAS number of 1-(5-Methyl-2-furanyl)-1,2-propanedione is 1197-20-2.
What is the molecular formula of 1-(5-Methyl-2-furanyl)-1,2-propanedione?
The molecular formula of 1-(5-Methyl-2-furanyl)-1,2-propanedione is C8H8O3.
What is the molecular weight of 1-(5-Methyl-2-furanyl)-1,2-propanedione?
The molecular weight of 1-(5-Methyl-2-furanyl)-1,2-propanedione is 152.05 g/mol.
Where can I buy 1-(5-Methyl-2-furanyl)-1,2-propanedione?
You can request a quote for 1-(5-Methyl-2-furanyl)-1,2-propanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Methyl-2-furanyl)-1,2-propanedione?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Methyl-2-furanyl)-1,2-propanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.