![1-[Chloro(dinitro)methyl]adamantane structure](/static/products/1613/161373-18-8.webp)
1-[Chloro(dinitro)methyl]adamantane
TL;DR: 1-[Chloro(dinitro)methyl]adamantane (CAS 161373-18-8) is a chemical compound with molecular formula C11H15ClN2O4 and molecular weight 274.07202 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[chloro(dinitro)methyl]adamantane
Also Known As: 1-[chloro(dinitro)methyl]adamantane, 1-(Chlorodinitromethyl)tricyclo[3.3.1.13,7]decane
Technical Specifications
| Molecular Formula | C11H15ClN2O4 |
| Molecular Weight | 274.07202 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 274.07202 Da |
| Heavy Atoms | 18 |
| Complexity | 359.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)C([N+](=O)[O-])([N+](=O)[O-])Cl |
| InChIKey | PZZDZWRGKOFIQQ-UHFFFAOYSA-N |
Chemical Property Profile of 1-[Chloro(dinitro)methyl]adamantane
Property Insights of 1-[Chloro(dinitro)methyl]adamantane
The XLogP value of 3.5 indicates that 1-[Chloro(dinitro)methyl]adamantane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[Chloro(dinitro)methyl]adamantane. Following Lipinski's Rule of Five, 1-[Chloro(dinitro)methyl]adamantane has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-[Chloro(dinitro)methyl]adamantane?
The CAS number of 1-[Chloro(dinitro)methyl]adamantane is 161373-18-8.
What is the molecular formula of 1-[Chloro(dinitro)methyl]adamantane?
The molecular formula of 1-[Chloro(dinitro)methyl]adamantane is C11H15ClN2O4.
What is the molecular weight of 1-[Chloro(dinitro)methyl]adamantane?
The molecular weight of 1-[Chloro(dinitro)methyl]adamantane is 274.07202 g/mol.
Where can I buy 1-[Chloro(dinitro)methyl]adamantane?
You can request a quote for 1-[Chloro(dinitro)methyl]adamantane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-[Chloro(dinitro)methyl]adamantane?
Yes, CoreyChem provides custom synthesis services for 1-[Chloro(dinitro)methyl]adamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.