二氯喹啉酸
TL;DR: 二氯喹啉酸 (CAS 84087-01-4) is a chemical compound with molecular formula C10H5Cl2NO2 and molecular weight 240.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二氯喹啉酸
3,7-dichloroquinoline-8-carboxylic acid
Also Known As: Quinclorac, Quinchlorac, Facet, 3,7-Dichloroquinoline-8-carboxylic acid, Quinclorac tech
| Molecular Formula | C10H5Cl2NO2 |
|---|---|
| Molecular Weight | 240.97 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.96973 |
| Heavy Atoms | 15 |
| Complexity | 262.0 |
| Melting Point | 274 °C |
| Density | 1.75 |
| Solubility | In water, 0.065 mg/kg (pH 7, 20 °C) |
| Vapor Pressure | log Kow: -0.75 (pH 7). VP: <0.01mPa (20 °C) |
Chemical Identifiers
| CAS Number | 84087-01-4 |
|---|---|
| SMILES | C1=CC(=C(C2=NC=C(C=C21)Cl)C(=O)O)Cl |
| InChIKey | FFSSWMQPCJRCRV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二氯喹啉酸 (CAS 84087-01-4), with molecular formula C10H5Cl2NO2 and molecular weight 240.97 g/mol. IUPAC: 3,7-dichloroquinoline-8-carboxylic acid.
Chemical Property Profile of 二氯喹啉酸
Property Insights of 二氯喹啉酸
The XLogP value of 3.0 indicates that 二氯喹啉酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 二氯喹啉酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二氯喹啉酸 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 二氯喹啉酸?
The CAS number of 二氯喹啉酸 is 84087-01-4.
What is the molecular formula of 二氯喹啉酸?
The molecular formula of 二氯喹啉酸 is C10H5Cl2NO2.
What is the molecular weight of 二氯喹啉酸?
The molecular weight of 二氯喹啉酸 is 240.97 g/mol.
Where can I buy 二氯喹啉酸?
You can request a quote for 二氯喹啉酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二氯喹啉酸?
Yes, KEHONG BIO provides custom synthesis services for 二氯喹啉酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.