4-Chloro-3-nitrophenylacetic Acid
TL;DR: 4-Chloro-3-nitrophenylacetic Acid (CAS 163395-25-3) is a chemical compound with molecular formula C8H6ClNO4 and molecular weight 215.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-3-nitrophenyl)acetic acid
Also Known As: 4-CHLORO-3-NITROPHENYLACETIC ACID, null, 2-(4-chloro-3-nitrophenyl)acetic acid, 3-nitro-4-chlorophenylacetic acid, (4-chloro-3-nitrophenyl)acetic acid
| Molecular Formula | C8H6ClNO4 |
|---|---|
| Molecular Weight | 215.00 g/mol |
| LogP | 1.8753 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 214.99854 |
| Heavy Atoms | 14 |
| Complexity | 390.9277 |
Chemical Identifiers
| CAS Number | 163395-25-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1CC(=O)O)[N+](=O)[O-])Cl |
Product Overview
4-Chloro-3-nitrophenylacetic Acid (CAS 163395-25-3), with molecular formula C8H6ClNO4 and molecular weight 215.00 g/mol. IUPAC: 2-(4-chloro-3-nitrophenyl)acetic acid.
Chemical Property Profile of 4-Chloro-3-nitrophenylacetic Acid
Property Insights of 4-Chloro-3-nitrophenylacetic Acid
The XLogP value of 1.8753 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-3-nitrophenylacetic Acid. The TPSA of 80.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-3-nitrophenylacetic Acid. Following Lipinski's Rule of Five, 4-Chloro-3-nitrophenylacetic Acid 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 4-Chloro-3-nitrophenylacetic Acid?
The CAS number of 4-Chloro-3-nitrophenylacetic Acid is 163395-25-3.
What is the molecular formula of 4-Chloro-3-nitrophenylacetic Acid?
The molecular formula of 4-Chloro-3-nitrophenylacetic Acid is C8H6ClNO4.
What is the molecular weight of 4-Chloro-3-nitrophenylacetic Acid?
The molecular weight of 4-Chloro-3-nitrophenylacetic Acid is 215.00 g/mol.
Where can I buy 4-Chloro-3-nitrophenylacetic Acid?
You can request a quote for 4-Chloro-3-nitrophenylacetic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3-nitrophenylacetic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3-nitrophenylacetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.