Methyl 5-(hydroxymethyl)-2-methyl-3-furoate
TL;DR: Methyl 5-(hydroxymethyl)-2-methyl-3-furoate (CAS 15341-69-2) is a chemical compound with molecular formula C8H10O4 and molecular weight 170.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(hydroxymethyl)-2-methylfuran-3-carboxylate
Also Known As: methyl 5-(hydroxymethyl)-2-methylfuran-3-carboxylate, methyl 5-(hydroxymethyl)-2-methyl-3-furoate, 5-Hydroxymethyl-2-methyl-furan-3-carboxylic acid methyl ester, methyl5-(hydroxymethyl)-2-methyl-3-furoate, J1.135.469F
| Molecular Formula | C8H10O4 |
|---|---|
| Molecular Weight | 170.06 g/mol |
| LogP | 0.86692 |
| Topological Polar Surface Area | 59.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.0579 |
| Heavy Atoms | 12 |
| Complexity | 287.24802 |
Chemical Identifiers
| CAS Number | 15341-69-2 |
|---|---|
| SMILES | CC1=C(C=C(O1)CO)C(=O)OC |
Product Overview
Methyl 5-(hydroxymethyl)-2-methyl-3-furoate (CAS 15341-69-2), with molecular formula C8H10O4 and molecular weight 170.06 g/mol. IUPAC: methyl 5-(hydroxymethyl)-2-methylfuran-3-carboxylate.
Chemical Property Profile of Methyl 5-(hydroxymethyl)-2-methyl-3-furoate
Property Insights of Methyl 5-(hydroxymethyl)-2-methyl-3-furoate
The XLogP value of 0.86692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-(hydroxymethyl)-2-methyl-3-furoate. With a topological polar surface area (TPSA) of 59.67 Ų, Methyl 5-(hydroxymethyl)-2-methyl-3-furoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 5-(hydroxymethyl)-2-methyl-3-furoate has 1 hydrogen bond donor(s) and 4 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 5-(hydroxymethyl)-2-methyl-3-furoate?
The CAS number of Methyl 5-(hydroxymethyl)-2-methyl-3-furoate is 15341-69-2.
What is the molecular formula of Methyl 5-(hydroxymethyl)-2-methyl-3-furoate?
The molecular formula of Methyl 5-(hydroxymethyl)-2-methyl-3-furoate is C8H10O4.
What is the molecular weight of Methyl 5-(hydroxymethyl)-2-methyl-3-furoate?
The molecular weight of Methyl 5-(hydroxymethyl)-2-methyl-3-furoate is 170.06 g/mol.
Where can I buy Methyl 5-(hydroxymethyl)-2-methyl-3-furoate?
You can request a quote for Methyl 5-(hydroxymethyl)-2-methyl-3-furoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-(hydroxymethyl)-2-methyl-3-furoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-(hydroxymethyl)-2-methyl-3-furoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.