![2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid structure](/static/products/3000/30005-95-9.webp)
2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid
TL;DR: 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid (CAS 30005-95-9) is a chemical compound with molecular formula C9H8O5 and molecular weight 196.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-methylfuran-2-yl)methylidene]propanedioic acid
Also Known As: 2-(5-Methylfuran-2-yl)methylidenemalonic acid, 2-[(5-methylfuran-2-yl)methylidene]propanedioic acid, NCI60_023413, 2-[(5-methyl-2-furyl)methylene]propanedioic acid, Propanedioic acid, [(5-methyl-2-furanyl)methylene]-
| Molecular Formula | C9H8O5 |
|---|---|
| Molecular Weight | 196.04 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.03717 |
| Heavy Atoms | 14 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 30005-95-9 |
|---|---|
| SMILES | CC1=CC=C(O1)C=C(C(=O)O)C(=O)O |
| InChIKey | STUYIPPGFOEHIL-UHFFFAOYSA-N |
Product Overview
2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid (CAS 30005-95-9), with molecular formula C9H8O5 and molecular weight 196.04 g/mol. IUPAC: 2-[(5-methylfuran-2-yl)methylidene]propanedioic acid.
Chemical Property Profile of 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid
Property Insights of 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid. Following Lipinski's Rule of Five, 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid has 2 hydrogen bond donor(s) and 5 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 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid?
The CAS number of 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid is 30005-95-9.
What is the molecular formula of 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid?
The molecular formula of 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid is C9H8O5.
What is the molecular weight of 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid?
The molecular weight of 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid is 196.04 g/mol.
Where can I buy 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid?
You can request a quote for 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-Methylfuran-2-yl)methylidene]propanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.