邻苯二甲酸铵盐
TL;DR: 邻苯二甲酸铵盐 (CAS 20450-76-4) is a chemical compound with molecular formula C8H9NO4 and molecular weight 183.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
邻苯二甲酸铵盐
azane;phthalic acid
Also Known As: Phthalic acid, ammonium salt, azane,phthalic acid, azane; phthalic acid, ammonium 2-carboxybenzoate, 243-830-0
| Molecular Formula | C8H9NO4 |
|---|---|
| Molecular Weight | 183.05 g/mol |
| LogP | 1.24 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.05316 |
| Heavy Atoms | 13 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 20450-76-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)C(=O)O.N |
| InChIKey | OSKNUZYLXFBIHL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
邻苯二甲酸铵盐 (CAS 20450-76-4), with molecular formula C8H9NO4 and molecular weight 183.05 g/mol. IUPAC: azane;phthalic acid.
Chemical Property Profile of 邻苯二甲酸铵盐
Property Insights of 邻苯二甲酸铵盐
The XLogP value of 1.24 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 邻苯二甲酸铵盐. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 邻苯二甲酸铵盐. Following Lipinski's Rule of Five, 邻苯二甲酸铵盐 has 3 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 邻苯二甲酸铵盐?
The CAS number of 邻苯二甲酸铵盐 is 20450-76-4.
What is the molecular formula of 邻苯二甲酸铵盐?
The molecular formula of 邻苯二甲酸铵盐 is C8H9NO4.
What is the molecular weight of 邻苯二甲酸铵盐?
The molecular weight of 邻苯二甲酸铵盐 is 183.05 g/mol.
Where can I buy 邻苯二甲酸铵盐?
You can request a quote for 邻苯二甲酸铵盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 邻苯二甲酸铵盐?
Yes, KEHONG BIO provides custom synthesis services for 邻苯二甲酸铵盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.