2-Propyladamantane
TL;DR: 2-Propyladamantane (CAS 14451-88-8) is a chemical compound with molecular formula C13H22 and molecular weight 178.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propyladamantane
Also Known As: 2-Propyladamantane, 2-n-Propyladamantane, 2-Propyladamantane #, J1.894.632G
| Molecular Formula | C13H22 |
|---|---|
| Molecular Weight | 178.17 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.17215 |
| Heavy Atoms | 13 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 14451-88-8 |
|---|---|
| SMILES | CCCC1C2CC3CC(C2)CC1C3 |
| InChIKey | HMUYSRNQYPLWHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propyladamantane (CAS 14451-88-8), with molecular formula C13H22 and molecular weight 178.17 g/mol. IUPAC: 2-propyladamantane.
Chemical Property Profile of 2-Propyladamantane
Property Insights of 2-Propyladamantane
The XLogP value of 5.2 indicates that 2-Propyladamantane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Propyladamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propyladamantane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Propyladamantane?
The CAS number of 2-Propyladamantane is 14451-88-8.
What is the molecular formula of 2-Propyladamantane?
The molecular formula of 2-Propyladamantane is C13H22.
What is the molecular weight of 2-Propyladamantane?
The molecular weight of 2-Propyladamantane is 178.17 g/mol.
Where can I buy 2-Propyladamantane?
You can request a quote for 2-Propyladamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propyladamantane?
Yes, KEHONG BIO provides custom synthesis services for 2-Propyladamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.