Methyl 3-methyl-2-furoate
TL;DR: Methyl 3-methyl-2-furoate (CAS 6141-57-7) is a chemical compound with molecular formula C7H8O3 and molecular weight 140.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methylfuran-2-carboxylate
Also Known As: Methyl 3-methyl-2-furoate, methyl 3-methylfuran-2-carboxylate, Methyl 3-methylfuroate, methyl 3-methyl-2-furancarboxylate, 3-AMINOQUINOLINE
| Molecular Formula | C7H8O3 |
|---|---|
| Molecular Weight | 140.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.04735 |
| Heavy Atoms | 10 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 6141-57-7 |
|---|---|
| SMILES | CC1=C(OC=C1)C(=O)OC |
| InChIKey | AQQYRDKMXXSIMP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 3-methyl-2-furoate (CAS 6141-57-7), with molecular formula C7H8O3 and molecular weight 140.05 g/mol. IUPAC: methyl 3-methylfuran-2-carboxylate.
Chemical Property Profile of Methyl 3-methyl-2-furoate
Property Insights of Methyl 3-methyl-2-furoate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-methyl-2-furoate. With a topological polar surface area (TPSA) of 39.4 Ų, Methyl 3-methyl-2-furoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-methyl-2-furoate 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 Methyl 3-methyl-2-furoate?
The CAS number of Methyl 3-methyl-2-furoate is 6141-57-7.
What is the molecular formula of Methyl 3-methyl-2-furoate?
The molecular formula of Methyl 3-methyl-2-furoate is C7H8O3.
What is the molecular weight of Methyl 3-methyl-2-furoate?
The molecular weight of Methyl 3-methyl-2-furoate is 140.05 g/mol.
Where can I buy Methyl 3-methyl-2-furoate?
You can request a quote for Methyl 3-methyl-2-furoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-methyl-2-furoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-methyl-2-furoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.