异樱花素
TL;DR: 异樱花素 (CAS 480-43-3) is a chemical compound with molecular formula C9H7NO5 and molecular weight 209.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异樱花素
3-(4-nitrophenyl)-2-oxopropanoic acid
Also Known As: p-Nitrophenylpyruvic acid, 3-(4-Nitrophenyl)-2-oxopropanoic acid, (p-Nitrophenyl)pyruvic acid, p - Nitrophenylpyruvic acid, (4-nitrophenyl)pyruvic acid
| Molecular Formula | C9H7NO5 |
|---|---|
| Molecular Weight | 209.03 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.03242 |
| Heavy Atoms | 15 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 480-43-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CC(=O)C(=O)O)[N+](=O)[O-] |
| InChIKey | CIGYFQSAFKLMAL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异樱花素 (CAS 480-43-3), with molecular formula C9H7NO5 and molecular weight 209.03 g/mol. IUPAC: 3-(4-nitrophenyl)-2-oxopropanoic acid.
Chemical Property Profile of 异樱花素
Property Insights of 异樱花素
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 异樱花素. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 异樱花素. Following Lipinski's Rule of Five, 异樱花素 has 1 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 异樱花素?
The CAS number of 异樱花素 is 480-43-3.
What is the molecular formula of 异樱花素?
The molecular formula of 异樱花素 is C9H7NO5.
What is the molecular weight of 异樱花素?
The molecular weight of 异樱花素 is 209.03 g/mol.
Where can I buy 异樱花素?
You can request a quote for 异樱花素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异樱花素?
Yes, KEHONG BIO provides custom synthesis services for 异樱花素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.