芸香糖
TL;DR: 芸香糖 (CAS 90-74-4) is a chemical compound with molecular formula C6H4ClFN2O2 and molecular weight 189.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
芸香糖
5-chloro-2-fluoro-4-nitroaniline
Also Known As: Rutinose, 5-chloro-2-fluoro-4-nitroaniline, Benzenamine, 5-chloro-2-fluoro-4-nitro-
| Molecular Formula | C6H4ClFN2O2 |
|---|---|
| Molecular Weight | 189.99 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.99454 |
| Heavy Atoms | 12 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 90-74-4 |
|---|---|
| SMILES | C1=C(C(=CC(=C1Cl)[N+](=O)[O-])F)N |
| InChIKey | CKDVOPJPNALABG-UHFFFAOYSA-N |
Product Overview
芸香糖 (CAS 90-74-4), with molecular formula C6H4ClFN2O2 and molecular weight 189.99 g/mol. IUPAC: 5-chloro-2-fluoro-4-nitroaniline.
Chemical Property Profile of 芸香糖
Property Insights of 芸香糖
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 芸香糖. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 芸香糖. Following Lipinski's Rule of Five, 芸香糖 has 1 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 芸香糖?
The CAS number of 芸香糖 is 90-74-4.
What is the molecular formula of 芸香糖?
The molecular formula of 芸香糖 is C6H4ClFN2O2.
What is the molecular weight of 芸香糖?
The molecular weight of 芸香糖 is 189.99 g/mol.
Where can I buy 芸香糖?
You can request a quote for 芸香糖 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 芸香糖?
Yes, KEHONG BIO provides custom synthesis services for 芸香糖 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.