1-Isopropenyladamantane
TL;DR: 1-Isopropenyladamantane (CAS 773-33-1) is a chemical compound with molecular formula C13H20 and molecular weight 176.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-prop-1-en-2-yladamantane
Also Known As: 1-isopropenyladamantane, 2-(1-adamantyl)propene, 1-prop-1-en-2-yladamantane, 1-(prop-1-en-2-yl)adamantane, (3r)-1-(prop-1-en-2-yl)adamantane
| Molecular Formula | C13H20 |
|---|---|
| Molecular Weight | 176.16 g/mol |
| LogP | 3.7789 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.1565 |
| Heavy Atoms | 13 |
| Complexity | 213.4797 |
Chemical Identifiers
| CAS Number | 773-33-1 |
|---|---|
| SMILES | CC(=C)C12CC3CC(C1)CC(C3)C2 |
Product Overview
1-Isopropenyladamantane (CAS 773-33-1), with molecular formula C13H20 and molecular weight 176.16 g/mol. IUPAC: 1-prop-1-en-2-yladamantane.
Chemical Property Profile of 1-Isopropenyladamantane
Property Insights of 1-Isopropenyladamantane
The XLogP value of 3.7789 indicates that 1-Isopropenyladamantane 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-Isopropenyladamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Isopropenyladamantane 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-Isopropenyladamantane?
The CAS number of 1-Isopropenyladamantane is 773-33-1.
What is the molecular formula of 1-Isopropenyladamantane?
The molecular formula of 1-Isopropenyladamantane is C13H20.
What is the molecular weight of 1-Isopropenyladamantane?
The molecular weight of 1-Isopropenyladamantane is 176.16 g/mol.
Where can I buy 1-Isopropenyladamantane?
You can request a quote for 1-Isopropenyladamantane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Isopropenyladamantane?
Yes, KEHONG BIO provides custom synthesis services for 1-Isopropenyladamantane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.