1-(3-Bromophenyl)adamantane
TL;DR: 1-(3-Bromophenyl)adamantane (CAS 1459-53-6) is a chemical compound with molecular formula C16H19Br and molecular weight 290.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromophenyl)adamantane
Also Known As: 1-(3-bromophenyl)adamantane, 1-m-bromophenyladamantane, 1-adamantanyl-3-bromobenzene, 1-(3-Bromo-phenyl)-adamantane, BAS 00285061
| Molecular Formula | C16H19Br |
|---|---|
| Molecular Weight | 290.07 g/mol |
| LogP | 4.9169 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.06702 |
| Heavy Atoms | 17 |
| Complexity | 413.3091 |
Chemical Identifiers
| CAS Number | 1459-53-6 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C4=CC(=CC=C4)Br |
Product Overview
1-(3-Bromophenyl)adamantane (CAS 1459-53-6), with molecular formula C16H19Br and molecular weight 290.07 g/mol. IUPAC: 1-(3-bromophenyl)adamantane.
Chemical Property Profile of 1-(3-Bromophenyl)adamantane
Property Insights of 1-(3-Bromophenyl)adamantane
The XLogP value of 4.9169 indicates that 1-(3-Bromophenyl)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-(3-Bromophenyl)adamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Bromophenyl)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-(3-Bromophenyl)adamantane?
The CAS number of 1-(3-Bromophenyl)adamantane is 1459-53-6.
What is the molecular formula of 1-(3-Bromophenyl)adamantane?
The molecular formula of 1-(3-Bromophenyl)adamantane is C16H19Br.
What is the molecular weight of 1-(3-Bromophenyl)adamantane?
The molecular weight of 1-(3-Bromophenyl)adamantane is 290.07 g/mol.
Where can I buy 1-(3-Bromophenyl)adamantane?
You can request a quote for 1-(3-Bromophenyl)adamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Bromophenyl)adamantane?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Bromophenyl)adamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.