4-氟苯-1,2-二甲酸
TL;DR: 4-氟苯-1,2-二甲酸 (CAS 320-97-8) is a chemical compound with molecular formula C8H5FO4 and molecular weight 184.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氟苯-1,2-二甲酸
4-fluorophthalic acid
Also Known As: 4-FLUOROPHTHALIC ACID, 4-Fluorobenzene-1,2-dicarboxylic acid, 3-Fluorophthalic acid, 3-fluorophthalicacid, 4-Fluorophthalicacid
| Molecular Formula | C8H5FO4 |
|---|---|
| Molecular Weight | 184.02 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.01718 |
| Heavy Atoms | 13 |
| Complexity | 228.0 |
Chemical Identifiers
| CAS Number | 320-97-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)C(=O)O)C(=O)O |
| InChIKey | OMCXTFVBNCFZMY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氟苯-1,2-二甲酸 (CAS 320-97-8), with molecular formula C8H5FO4 and molecular weight 184.02 g/mol. IUPAC: 4-fluorophthalic acid.
Chemical Property Profile of 4-氟苯-1,2-二甲酸
Property Insights of 4-氟苯-1,2-二甲酸
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氟苯-1,2-二甲酸. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-氟苯-1,2-二甲酸. Following Lipinski's Rule of Five, 4-氟苯-1,2-二甲酸 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 4-氟苯-1,2-二甲酸?
The CAS number of 4-氟苯-1,2-二甲酸 is 320-97-8.
What is the molecular formula of 4-氟苯-1,2-二甲酸?
The molecular formula of 4-氟苯-1,2-二甲酸 is C8H5FO4.
What is the molecular weight of 4-氟苯-1,2-二甲酸?
The molecular weight of 4-氟苯-1,2-二甲酸 is 184.02 g/mol.
Where can I buy 4-氟苯-1,2-二甲酸?
You can request a quote for 4-氟苯-1,2-二甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氟苯-1,2-二甲酸?
Yes, KEHONG BIO provides custom synthesis services for 4-氟苯-1,2-二甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.