![5-[(Methylthio)methyl]-2-furoic acid structure](/static/products/940/94084-70-5.png)
5-[(Methylthio)methyl]-2-furoic acid
TL;DR: 5-[(Methylthio)methyl]-2-furoic acid (CAS 94084-70-5) is a chemical compound with molecular formula C7H8O3S and molecular weight 172.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(methylsulfanylmethyl)furan-2-carboxylic acid
Also Known As: 5-[(methylthio)methyl]-2-furoic acid, 5-[(methylsulfanyl)methyl]furan-2-carboxylic acid, 5-(methylsulfanylmethyl)furan-2-carboxylic Acid, 5-[ METHYL]-2-FUROICACID, 5-(methylthio)methyl-2-furoic acid
| Molecular Formula | C7H8O3S |
|---|---|
| Molecular Weight | 172.02 g/mol |
| LogP | 1.8408 |
| Topological Polar Surface Area | 50.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 172.01941 |
| Heavy Atoms | 11 |
| Complexity | 253.9433 |
Chemical Identifiers
| CAS Number | 94084-70-5 |
|---|---|
| SMILES | CSCC1=CC=C(O1)C(=O)O |
Product Overview
5-[(Methylthio)methyl]-2-furoic acid (CAS 94084-70-5), with molecular formula C7H8O3S and molecular weight 172.02 g/mol. IUPAC: 5-(methylsulfanylmethyl)furan-2-carboxylic acid.
Chemical Property Profile of 5-[(Methylthio)methyl]-2-furoic acid
Property Insights of 5-[(Methylthio)methyl]-2-furoic acid
The XLogP value of 1.8408 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[(Methylthio)methyl]-2-furoic acid. With a topological polar surface area (TPSA) of 50.44 Ų, 5-[(Methylthio)methyl]-2-furoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-[(Methylthio)methyl]-2-furoic acid has 1 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 5-[(Methylthio)methyl]-2-furoic acid?
The CAS number of 5-[(Methylthio)methyl]-2-furoic acid is 94084-70-5.
What is the molecular formula of 5-[(Methylthio)methyl]-2-furoic acid?
The molecular formula of 5-[(Methylthio)methyl]-2-furoic acid is C7H8O3S.
What is the molecular weight of 5-[(Methylthio)methyl]-2-furoic acid?
The molecular weight of 5-[(Methylthio)methyl]-2-furoic acid is 172.02 g/mol.
Where can I buy 5-[(Methylthio)methyl]-2-furoic acid?
You can request a quote for 5-[(Methylthio)methyl]-2-furoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[(Methylthio)methyl]-2-furoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[(Methylthio)methyl]-2-furoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.