3-Chloro-2,4(3H,5H)-furandione
TL;DR: 3-Chloro-2,4(3H,5H)-furandione (CAS 4971-55-5) is a chemical compound with molecular formula C4H3ClO3 and molecular weight 133.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chlorooxolane-2,4-dione
Also Known As: 3-Chloro-2,4(3H,5H)-furandione, 3-chlorooxolane-2,4-dione, 3-chlorofuran-2,4(3H,5H)-dione, 3-Chlorotetronic acid, 3-Chloro-furan-2,4-dione
| Molecular Formula | C4H3ClO3 |
|---|---|
| Molecular Weight | 133.98 g/mol |
| LogP | -0.2803 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 133.97707 |
| Heavy Atoms | 8 |
| Complexity | 126.21885 |
Chemical Identifiers
| CAS Number | 4971-55-5 |
|---|---|
| SMILES | C1C(=O)C(C(=O)O1)Cl |
Product Overview
3-Chloro-2,4(3H,5H)-furandione (CAS 4971-55-5), with molecular formula C4H3ClO3 and molecular weight 133.98 g/mol. IUPAC: 3-chlorooxolane-2,4-dione.
Chemical Property Profile of 3-Chloro-2,4(3H,5H)-furandione
Property Insights of 3-Chloro-2,4(3H,5H)-furandione
The XLogP value of -0.2803 indicates that 3-Chloro-2,4(3H,5H)-furandione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.37 Ų, 3-Chloro-2,4(3H,5H)-furandione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-2,4(3H,5H)-furandione 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 3-Chloro-2,4(3H,5H)-furandione?
The CAS number of 3-Chloro-2,4(3H,5H)-furandione is 4971-55-5.
What is the molecular formula of 3-Chloro-2,4(3H,5H)-furandione?
The molecular formula of 3-Chloro-2,4(3H,5H)-furandione is C4H3ClO3.
What is the molecular weight of 3-Chloro-2,4(3H,5H)-furandione?
The molecular weight of 3-Chloro-2,4(3H,5H)-furandione is 133.98 g/mol.
Where can I buy 3-Chloro-2,4(3H,5H)-furandione?
You can request a quote for 3-Chloro-2,4(3H,5H)-furandione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-2,4(3H,5H)-furandione?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-2,4(3H,5H)-furandione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.