4-硝基-1-萘胺
TL;DR: 4-硝基-1-萘胺 (CAS 776-34-1) is a chemical compound with molecular formula C10H8N2O2 and molecular weight 188.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-硝基-1-萘胺
4-nitronaphthalen-1-amine
Also Known As: 4-Nitro-1-naphthylamine, 4-nitronaphthalen-1-amine, 1-Amino-4-nitronaphthalene, 1-Naphthalenamine, 4-nitro-, 1,4-Nitronaphthylamine
| Molecular Formula | C10H8N2O2 |
|---|---|
| Molecular Weight | 188.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.05858 |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 776-34-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=C2[N+](=O)[O-])N |
| InChIKey | BVPJPRYNQHAOPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-硝基-1-萘胺 (CAS 776-34-1), with molecular formula C10H8N2O2 and molecular weight 188.06 g/mol. IUPAC: 4-nitronaphthalen-1-amine.
Chemical Property Profile of 4-硝基-1-萘胺
Property Insights of 4-硝基-1-萘胺
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-硝基-1-萘胺. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-硝基-1-萘胺. Following Lipinski's Rule of Five, 4-硝基-1-萘胺 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-硝基-1-萘胺?
The CAS number of 4-硝基-1-萘胺 is 776-34-1.
What is the molecular formula of 4-硝基-1-萘胺?
The molecular formula of 4-硝基-1-萘胺 is C10H8N2O2.
What is the molecular weight of 4-硝基-1-萘胺?
The molecular weight of 4-硝基-1-萘胺 is 188.06 g/mol.
Where can I buy 4-硝基-1-萘胺?
You can request a quote for 4-硝基-1-萘胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-硝基-1-萘胺?
Yes, KEHONG BIO provides custom synthesis services for 4-硝基-1-萘胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.