Ethyl 2-(adamantan-2-ylidene)acetate
TL;DR: Ethyl 2-(adamantan-2-ylidene)acetate (CAS 25220-06-8) is a chemical compound with molecular formula C14H20O2 and molecular weight 220.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2-adamantylidene)acetate
Also Known As: ethyl 2-(adamantan-2-ylidene)acetate, starbld0005429, Ethyl adamantylideneacetate, ethyl 2-(2-adamantylidene)acetate, Adamantane-2-ylideneacetic acid ethyl ester
| Molecular Formula | C14H20O2 |
|---|---|
| Molecular Weight | 220.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.14633 |
| Heavy Atoms | 16 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 25220-06-8 |
|---|---|
| SMILES | CCOC(=O)C=C1C2CC3CC(C2)CC1C3 |
| InChIKey | YVNAFECGMVREFD-UHFFFAOYSA-N |
Product Overview
Ethyl 2-(adamantan-2-ylidene)acetate (CAS 25220-06-8), with molecular formula C14H20O2 and molecular weight 220.15 g/mol. IUPAC: ethyl 2-(2-adamantylidene)acetate.
Chemical Property Profile of Ethyl 2-(adamantan-2-ylidene)acetate
Property Insights of Ethyl 2-(adamantan-2-ylidene)acetate
The XLogP value of 3.2 indicates that Ethyl 2-(adamantan-2-ylidene)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl 2-(adamantan-2-ylidene)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-(adamantan-2-ylidene)acetate has 0 hydrogen bond donor(s) and 2 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 Ethyl 2-(adamantan-2-ylidene)acetate?
The CAS number of Ethyl 2-(adamantan-2-ylidene)acetate is 25220-06-8.
What is the molecular formula of Ethyl 2-(adamantan-2-ylidene)acetate?
The molecular formula of Ethyl 2-(adamantan-2-ylidene)acetate is C14H20O2.
What is the molecular weight of Ethyl 2-(adamantan-2-ylidene)acetate?
The molecular weight of Ethyl 2-(adamantan-2-ylidene)acetate is 220.15 g/mol.
Where can I buy Ethyl 2-(adamantan-2-ylidene)acetate?
You can request a quote for Ethyl 2-(adamantan-2-ylidene)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(adamantan-2-ylidene)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(adamantan-2-ylidene)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.