2'-硝基邻苯二甲酰苯胺酸
TL;DR: 2'-硝基邻苯二甲酰苯胺酸 (CAS 104199-17-9) is a chemical compound with molecular formula C14H10N2O5 and molecular weight 286.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2'-硝基邻苯二甲酰苯胺酸
2-[(2-nitrophenyl)carbamoyl]benzoic acid
Also Known As: 2'-nitrophthalanilic acid, 2-[(2-nitrophenyl)carbamoyl]benzoic acid, Phthalanilic acid, 2'-nitro-, 2-(2-Nitrophenylcarbamoyl)benzoic acid, 2-(2-nitrophenylaminocarbonyl)benzoic acid
| Molecular Formula | C14H10N2O5 |
|---|---|
| Molecular Weight | 286.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.05896 |
| Heavy Atoms | 21 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 104199-17-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)NC2=CC=CC=C2[N+](=O)[O-])C(=O)O |
| InChIKey | ZBUFPOWZVYVWNV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2'-硝基邻苯二甲酰苯胺酸 (CAS 104199-17-9), with molecular formula C14H10N2O5 and molecular weight 286.06 g/mol. IUPAC: 2-[(2-nitrophenyl)carbamoyl]benzoic acid.
Chemical Property Profile of 2'-硝基邻苯二甲酰苯胺酸
Property Insights of 2'-硝基邻苯二甲酰苯胺酸
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-硝基邻苯二甲酰苯胺酸. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2'-硝基邻苯二甲酰苯胺酸. Following Lipinski's Rule of Five, 2'-硝基邻苯二甲酰苯胺酸 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 2'-硝基邻苯二甲酰苯胺酸?
The CAS number of 2'-硝基邻苯二甲酰苯胺酸 is 104199-17-9.
What is the molecular formula of 2'-硝基邻苯二甲酰苯胺酸?
The molecular formula of 2'-硝基邻苯二甲酰苯胺酸 is C14H10N2O5.
What is the molecular weight of 2'-硝基邻苯二甲酰苯胺酸?
The molecular weight of 2'-硝基邻苯二甲酰苯胺酸 is 286.06 g/mol.
Where can I buy 2'-硝基邻苯二甲酰苯胺酸?
You can request a quote for 2'-硝基邻苯二甲酰苯胺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-硝基邻苯二甲酰苯胺酸?
Yes, KEHONG BIO provides custom synthesis services for 2'-硝基邻苯二甲酰苯胺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.