5-硝基-1-萘甲醛
TL;DR: 5-硝基-1-萘甲醛 (CAS 76505-93-6) is a chemical compound with molecular formula C11H7NO3 and molecular weight 201.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-硝基-1-萘甲醛
5-nitronaphthalene-1-carbaldehyde
Also Known As: 5-NITRO-1-NAPHTHALDEHYDE, 5-Nitronaphthaldehyd, 5-nitronaphthalene-1-carbaldehyde, 1-Naphthalenecarboxaldehyde,5-nitro-, RefChem:304360
| Molecular Formula | C11H7NO3 |
|---|---|
| Molecular Weight | 201.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.04259 |
| Heavy Atoms | 15 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 76505-93-6 |
|---|---|
| SMILES | C1=CC(=C2C=CC=C(C2=C1)[N+](=O)[O-])C=O |
| InChIKey | JYJDWOKNSHADGZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-硝基-1-萘甲醛 (CAS 76505-93-6), with molecular formula C11H7NO3 and molecular weight 201.04 g/mol. IUPAC: 5-nitronaphthalene-1-carbaldehyde.
Chemical Property Profile of 5-硝基-1-萘甲醛
Property Insights of 5-硝基-1-萘甲醛
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-硝基-1-萘甲醛. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-硝基-1-萘甲醛. Following Lipinski's Rule of Five, 5-硝基-1-萘甲醛 has 0 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 5-硝基-1-萘甲醛?
The CAS number of 5-硝基-1-萘甲醛 is 76505-93-6.
What is the molecular formula of 5-硝基-1-萘甲醛?
The molecular formula of 5-硝基-1-萘甲醛 is C11H7NO3.
What is the molecular weight of 5-硝基-1-萘甲醛?
The molecular weight of 5-硝基-1-萘甲醛 is 201.04 g/mol.
Where can I buy 5-硝基-1-萘甲醛?
You can request a quote for 5-硝基-1-萘甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-硝基-1-萘甲醛?
Yes, KEHONG BIO provides custom synthesis services for 5-硝基-1-萘甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.