1-Nitroadamantane
TL;DR: 1-Nitroadamantane (CAS 7575-82-8) is a chemical compound with molecular formula C10H15NO2 and molecular weight 181.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitroadamantane
Also Known As: 1-Nitroadamantane, nitroadamantane, Adamantane, 1-nitro-, Nitro Adamantane, 1-Nitro-adamantane
| Molecular Formula | C10H15NO2 |
|---|---|
| Molecular Weight | 181.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.11028 |
| Heavy Atoms | 13 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 7575-82-8 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)[N+](=O)[O-] |
| InChIKey | HONLSNLUVRQMEK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Nitroadamantane (CAS 7575-82-8), with molecular formula C10H15NO2 and molecular weight 181.11 g/mol. IUPAC: 1-nitroadamantane.
Chemical Property Profile of 1-Nitroadamantane
Property Insights of 1-Nitroadamantane
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Nitroadamantane. With a topological polar surface area (TPSA) of 45.8 Ų, 1-Nitroadamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Nitroadamantane 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 1-Nitroadamantane?
The CAS number of 1-Nitroadamantane is 7575-82-8.
What is the molecular formula of 1-Nitroadamantane?
The molecular formula of 1-Nitroadamantane is C10H15NO2.
What is the molecular weight of 1-Nitroadamantane?
The molecular weight of 1-Nitroadamantane is 181.11 g/mol.
Where can I buy 1-Nitroadamantane?
You can request a quote for 1-Nitroadamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitroadamantane?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitroadamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.