3-(2-Nitrophenyl)pentanedioic acid
TL;DR: 3-(2-Nitrophenyl)pentanedioic acid (CAS 423745-03-3) is a chemical compound with molecular formula C11H11NO6 and molecular weight 253.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-nitrophenyl)pentanedioic acid
Also Known As: 3-(2-nitrophenyl)pentanedioic acid, starbld0012249, BIM-0038390.P001
| Molecular Formula | C11H11NO6 |
|---|---|
| Molecular Weight | 253.06 g/mol |
| LogP | 1.6278 |
| Topological Polar Surface Area | 117.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 253.05864 |
| Heavy Atoms | 18 |
| Complexity | 468.1767 |
Chemical Identifiers
| CAS Number | 423745-03-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(CC(=O)O)CC(=O)O)[N+](=O)[O-] |
Product Overview
3-(2-Nitrophenyl)pentanedioic acid (CAS 423745-03-3), with molecular formula C11H11NO6 and molecular weight 253.06 g/mol. IUPAC: 3-(2-nitrophenyl)pentanedioic acid.
Chemical Property Profile of 3-(2-Nitrophenyl)pentanedioic acid
Property Insights of 3-(2-Nitrophenyl)pentanedioic acid
The XLogP value of 1.6278 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Nitrophenyl)pentanedioic acid. The TPSA of 117.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-Nitrophenyl)pentanedioic acid. Following Lipinski's Rule of Five, 3-(2-Nitrophenyl)pentanedioic acid has 2 hydrogen bond donor(s) and 4 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 3-(2-Nitrophenyl)pentanedioic acid?
The CAS number of 3-(2-Nitrophenyl)pentanedioic acid is 423745-03-3.
What is the molecular formula of 3-(2-Nitrophenyl)pentanedioic acid?
The molecular formula of 3-(2-Nitrophenyl)pentanedioic acid is C11H11NO6.
What is the molecular weight of 3-(2-Nitrophenyl)pentanedioic acid?
The molecular weight of 3-(2-Nitrophenyl)pentanedioic acid is 253.06 g/mol.
Where can I buy 3-(2-Nitrophenyl)pentanedioic acid?
You can request a quote for 3-(2-Nitrophenyl)pentanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Nitrophenyl)pentanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Nitrophenyl)pentanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.