6-Nitrotetralin
TL;DR: 6-Nitrotetralin (CAS 19353-86-7) is a chemical compound with molecular formula C10H11NO2 and molecular weight 177.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-1,2,3,4-tetrahydronaphthalene
Also Known As: 6-Nitrotetralin, 6-Nitro-1,2,3,4-tetrahydronaphthalene, 2-nitrotetralin, 6-nitro-tetralin, 1,2,3,4-Tetrahydro-6-nitronaphthalene
| Molecular Formula | C10H11NO2 |
|---|---|
| Molecular Weight | 177.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.07898 |
| Heavy Atoms | 13 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 19353-86-7 |
|---|---|
| SMILES | C1CCC2=C(C1)C=CC(=C2)[N+](=O)[O-] |
| InChIKey | OMJAUAQKUSAPIJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Nitrotetralin (CAS 19353-86-7), with molecular formula C10H11NO2 and molecular weight 177.08 g/mol. IUPAC: 6-nitro-1,2,3,4-tetrahydronaphthalene.
Chemical Property Profile of 6-Nitrotetralin
Property Insights of 6-Nitrotetralin
The XLogP value of 3.1 indicates that 6-Nitrotetralin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 6-Nitrotetralin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Nitrotetralin has 0 hydrogen bond donor(s) and 2 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 6-Nitrotetralin?
The CAS number of 6-Nitrotetralin is 19353-86-7.
What is the molecular formula of 6-Nitrotetralin?
The molecular formula of 6-Nitrotetralin is C10H11NO2.
What is the molecular weight of 6-Nitrotetralin?
The molecular weight of 6-Nitrotetralin is 177.08 g/mol.
Where can I buy 6-Nitrotetralin?
You can request a quote for 6-Nitrotetralin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitrotetralin?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitrotetralin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.