5-乙基喹啉酸
TL;DR: 5-乙基喹啉酸 (CAS 102268-15-5) is a chemical compound with molecular formula C9H9NO4 and molecular weight 195.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-乙基喹啉酸
5-ethylpyridine-2,3-dicarboxylic acid
Also Known As: 5-Ethylpyridine-2,3-dicarboxylic acid, 5-Ethylquinolinic acid, 2,3-Pyridinedicarboxylic acid, 5-ethyl-, 5-Ethyl-2,3-pyridinedicarboxylic acid, Imazethapyr Impurity 9
| Molecular Formula | C9H9NO4 |
|---|---|
| Molecular Weight | 195.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 87.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.05316 |
| Heavy Atoms | 14 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 102268-15-5 |
|---|---|
| SMILES | CCC1=CC(=C(N=C1)C(=O)O)C(=O)O |
| InChIKey | MTAVBTGOXNGCJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-乙基喹啉酸 (CAS 102268-15-5), with molecular formula C9H9NO4 and molecular weight 195.05 g/mol. IUPAC: 5-ethylpyridine-2,3-dicarboxylic acid.
Chemical Property Profile of 5-乙基喹啉酸
Property Insights of 5-乙基喹啉酸
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-乙基喹啉酸. The TPSA of 87.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-乙基喹啉酸. Following Lipinski's Rule of Five, 5-乙基喹啉酸 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 5-乙基喹啉酸?
The CAS number of 5-乙基喹啉酸 is 102268-15-5.
What is the molecular formula of 5-乙基喹啉酸?
The molecular formula of 5-乙基喹啉酸 is C9H9NO4.
What is the molecular weight of 5-乙基喹啉酸?
The molecular weight of 5-乙基喹啉酸 is 195.05 g/mol.
Where can I buy 5-乙基喹啉酸?
You can request a quote for 5-乙基喹啉酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-乙基喹啉酸?
Yes, KEHONG BIO provides custom synthesis services for 5-乙基喹啉酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.