1,3,5-Trichloroadamantane
TL;DR: 1,3,5-Trichloroadamantane (CAS 34059-96-6) is a chemical compound with molecular formula C10H13Cl3 and molecular weight 238.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-trichloroadamantane
Also Known As: 1,3,5-trichloroadamantane, (1r)-1,3,5-trichloroadamantane
| Molecular Formula | C10H13Cl3 |
|---|---|
| Molecular Weight | 238.01 g/mol |
| LogP | 3.9168 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.00829 |
| Heavy Atoms | 13 |
| Complexity | 212.10149 |
Chemical Identifiers
| CAS Number | 34059-96-6 |
|---|---|
| SMILES | C1C2CC3(CC1(CC(C2)(C3)Cl)Cl)Cl |
Product Overview
1,3,5-Trichloroadamantane (CAS 34059-96-6), with molecular formula C10H13Cl3 and molecular weight 238.01 g/mol. IUPAC: 1,3,5-trichloroadamantane.
Chemical Property Profile of 1,3,5-Trichloroadamantane
Property Insights of 1,3,5-Trichloroadamantane
The XLogP value of 3.9168 indicates that 1,3,5-Trichloroadamantane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3,5-Trichloroadamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Trichloroadamantane 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 1,3,5-Trichloroadamantane?
The CAS number of 1,3,5-Trichloroadamantane is 34059-96-6.
What is the molecular formula of 1,3,5-Trichloroadamantane?
The molecular formula of 1,3,5-Trichloroadamantane is C10H13Cl3.
What is the molecular weight of 1,3,5-Trichloroadamantane?
The molecular weight of 1,3,5-Trichloroadamantane is 238.01 g/mol.
Where can I buy 1,3,5-Trichloroadamantane?
You can request a quote for 1,3,5-Trichloroadamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Trichloroadamantane?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Trichloroadamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.