1-Bromo-3-(1-bromoethyl)adamantane
TL;DR: 1-Bromo-3-(1-bromoethyl)adamantane (CAS 37845-01-5) is a chemical compound with molecular formula C12H18Br2 and molecular weight 319.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-3-(1-bromoethyl)adamantane
Also Known As: 1-bromo-3-(1-bromoethyl)adamantane, 1-Brom-3-(, A-bromethyl)-adamantan, 1-Bromo-1-(3-bromo-1-adamantyl)-ethan, tricyclo[3.3.1.1~3,7~]decane, 1-bromo-3-(1-bromoethyl)-
| Molecular Formula | C12H18Br2 |
|---|---|
| Molecular Weight | 319.98 g/mol |
| LogP | 4.5037 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 319.97754 |
| Heavy Atoms | 14 |
| Complexity | 245.04735 |
Chemical Identifiers
| CAS Number | 37845-01-5 |
|---|---|
| SMILES | CC(C12CC3CC(C1)CC(C3)(C2)Br)Br |
Product Overview
1-Bromo-3-(1-bromoethyl)adamantane (CAS 37845-01-5), with molecular formula C12H18Br2 and molecular weight 319.98 g/mol. IUPAC: 1-bromo-3-(1-bromoethyl)adamantane.
Chemical Property Profile of 1-Bromo-3-(1-bromoethyl)adamantane
Property Insights of 1-Bromo-3-(1-bromoethyl)adamantane
The XLogP value of 4.5037 indicates that 1-Bromo-3-(1-bromoethyl)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-Bromo-3-(1-bromoethyl)adamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-3-(1-bromoethyl)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
Frequently Asked Questions
What is the CAS number of 1-Bromo-3-(1-bromoethyl)adamantane?
The CAS number of 1-Bromo-3-(1-bromoethyl)adamantane is 37845-01-5.
What is the molecular formula of 1-Bromo-3-(1-bromoethyl)adamantane?
The molecular formula of 1-Bromo-3-(1-bromoethyl)adamantane is C12H18Br2.
What is the molecular weight of 1-Bromo-3-(1-bromoethyl)adamantane?
The molecular weight of 1-Bromo-3-(1-bromoethyl)adamantane is 319.98 g/mol.
Where can I buy 1-Bromo-3-(1-bromoethyl)adamantane?
You can request a quote for 1-Bromo-3-(1-bromoethyl)adamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-3-(1-bromoethyl)adamantane?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-3-(1-bromoethyl)adamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.