3-(4-Nitrophenyl)adamantan-1-ol
TL;DR: 3-(4-Nitrophenyl)adamantan-1-ol (CAS 42009-76-7) is a chemical compound with molecular formula C16H19NO3 and molecular weight 273.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-nitrophenyl)adamantan-1-ol
Also Known As: 3-(4-nitrophenyl)adamantan-1-ol, 3-(p-nitrophenyl)-1-adamantanol, (1s,3r,5R,7S)-3-(4-nitrophenyl)adamantan-1-ol, Cambridge id 5142920
| Molecular Formula | C16H19NO3 |
|---|---|
| Molecular Weight | 273.14 g/mol |
| LogP | 3.1775 |
| Topological Polar Surface Area | 63.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.1365 |
| Heavy Atoms | 20 |
| Complexity | 551.58966 |
Chemical Identifiers
| CAS Number | 42009-76-7 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)O)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
3-(4-Nitrophenyl)adamantan-1-ol (CAS 42009-76-7), with molecular formula C16H19NO3 and molecular weight 273.14 g/mol. IUPAC: 3-(4-nitrophenyl)adamantan-1-ol.
Chemical Property Profile of 3-(4-Nitrophenyl)adamantan-1-ol
Property Insights of 3-(4-Nitrophenyl)adamantan-1-ol
The XLogP value of 3.1775 indicates that 3-(4-Nitrophenyl)adamantan-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Nitrophenyl)adamantan-1-ol. Following Lipinski's Rule of Five, 3-(4-Nitrophenyl)adamantan-1-ol 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 3-(4-Nitrophenyl)adamantan-1-ol?
The CAS number of 3-(4-Nitrophenyl)adamantan-1-ol is 42009-76-7.
What is the molecular formula of 3-(4-Nitrophenyl)adamantan-1-ol?
The molecular formula of 3-(4-Nitrophenyl)adamantan-1-ol is C16H19NO3.
What is the molecular weight of 3-(4-Nitrophenyl)adamantan-1-ol?
The molecular weight of 3-(4-Nitrophenyl)adamantan-1-ol is 273.14 g/mol.
Where can I buy 3-(4-Nitrophenyl)adamantan-1-ol?
You can request a quote for 3-(4-Nitrophenyl)adamantan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Nitrophenyl)adamantan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Nitrophenyl)adamantan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.