1-(Bromomethyl)adamantane
TL;DR: 1-(Bromomethyl)adamantane (CAS 14651-42-4) is a chemical compound with molecular formula C11H17Br and molecular weight 228.05136 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(bromomethyl)adamantane
Also Known As: 1-(bromomethyl)adamantane, 1-bromomethyladamantane, adamantanylbromomethane, adamantylmethyl bromide, 1-adamantylmethylbromide
Technical Specifications
| Molecular Formula | C11H17Br |
| Molecular Weight | 228.05136 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 228.05136 Da |
| Heavy Atoms | 12 |
| Complexity | 156.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)CBr |
| InChIKey | RLRBYCAVZBQANU-UHFFFAOYSA-N |
Chemical Property Profile of 1-(Bromomethyl)adamantane
Property Insights of 1-(Bromomethyl)adamantane
The XLogP value of 3.9 indicates that 1-(Bromomethyl)adamantane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-(Bromomethyl)adamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Bromomethyl)adamantane has 0 hydrogen bond donor(s) and 0 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-(Bromomethyl)adamantane?
The CAS number of 1-(Bromomethyl)adamantane is 14651-42-4.
What is the molecular formula of 1-(Bromomethyl)adamantane?
The molecular formula of 1-(Bromomethyl)adamantane is C11H17Br.
What is the molecular weight of 1-(Bromomethyl)adamantane?
The molecular weight of 1-(Bromomethyl)adamantane is 228.05136 g/mol.
Where can I buy 1-(Bromomethyl)adamantane?
You can request a quote for 1-(Bromomethyl)adamantane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(Bromomethyl)adamantane?
Yes, CoreyChem provides custom synthesis services for 1-(Bromomethyl)adamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.