4-Chloro-3-(5-formylfuran-2-yl)benzoic acid
TL;DR: 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid (CAS 425630-53-1) is a chemical compound with molecular formula C12H7ClO4 and molecular weight 250.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3-(5-formylfuran-2-yl)benzoic acid
Also Known As: 4-chloro-3-(5-formylfuran-2-yl)benzoic acid, 4-Chloro-3-(5-formyl-furan-2-yl)-benzoic acid, SP632, 4-Chloro-3-(5-formyl-2-furanyl)-benzoic acid, 4-chloro-3-(5-formyl-2-furyl)benzoic Acid
| Molecular Formula | C12H7ClO4 |
|---|---|
| Molecular Weight | 250.00 g/mol |
| LogP | 3.1107 |
| Topological Polar Surface Area | 67.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 250.00328 |
| Heavy Atoms | 17 |
| Complexity | 585.9416 |
Chemical Identifiers
| CAS Number | 425630-53-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)C2=CC=C(O2)C=O)Cl |
Product Overview
4-Chloro-3-(5-formylfuran-2-yl)benzoic acid (CAS 425630-53-1), with molecular formula C12H7ClO4 and molecular weight 250.00 g/mol. IUPAC: 4-chloro-3-(5-formylfuran-2-yl)benzoic acid.
Chemical Property Profile of 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid
Property Insights of 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid
The XLogP value of 3.1107 indicates that 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid. Following Lipinski's Rule of Five, 4-Chloro-3-(5-formylfuran-2-yl)benzoic 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 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid?
The CAS number of 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid is 425630-53-1.
What is the molecular formula of 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid?
The molecular formula of 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid is C12H7ClO4.
What is the molecular weight of 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid?
The molecular weight of 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid is 250.00 g/mol.
Where can I buy 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid?
You can request a quote for 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3-(5-formylfuran-2-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.