Ethyl cyano(cyclododecylidene)acetate
TL;DR: Ethyl cyano(cyclododecylidene)acetate (CAS 184866-86-2) is a chemical compound with molecular formula C17H27NO2 and molecular weight 277.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-cyano-2-cyclododecylideneacetate
Also Known As: ethyl cyano(cyclododecylidene)acetate, ethyl 2-cyano-2-cyclododecylideneacetate, ethylcyano(cyclododecylidene)acetate, Ethyl 2-cyano-2-cyclododecylidene-acetate, Acetic acid, cyanocyclododecylidene-, ethyl ester
| Molecular Formula | C17H27NO2 |
|---|---|
| Molecular Weight | 277.20 g/mol |
| LogP | 4.67438 |
| Topological Polar Surface Area | 50.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.2042 |
| Heavy Atoms | 20 |
| Complexity | 351.6765 |
Chemical Identifiers
| CAS Number | 184866-86-2 |
|---|---|
| SMILES | CCOC(=O)C(=C1CCCCCCCCCCC1)C#N |
Product Overview
Ethyl cyano(cyclododecylidene)acetate (CAS 184866-86-2), with molecular formula C17H27NO2 and molecular weight 277.20 g/mol. IUPAC: ethyl 2-cyano-2-cyclododecylideneacetate.
Chemical Property Profile of Ethyl cyano(cyclododecylidene)acetate
Property Insights of Ethyl cyano(cyclododecylidene)acetate
The XLogP value of 4.67438 indicates that Ethyl cyano(cyclododecylidene)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.09 Ų, Ethyl cyano(cyclododecylidene)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl cyano(cyclododecylidene)acetate has 0 hydrogen bond donor(s) and 3 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 cyano(cyclododecylidene)acetate?
The CAS number of Ethyl cyano(cyclododecylidene)acetate is 184866-86-2.
What is the molecular formula of Ethyl cyano(cyclododecylidene)acetate?
The molecular formula of Ethyl cyano(cyclododecylidene)acetate is C17H27NO2.
What is the molecular weight of Ethyl cyano(cyclododecylidene)acetate?
The molecular weight of Ethyl cyano(cyclododecylidene)acetate is 277.20 g/mol.
Where can I buy Ethyl cyano(cyclododecylidene)acetate?
You can request a quote for Ethyl cyano(cyclododecylidene)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl cyano(cyclododecylidene)acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl cyano(cyclododecylidene)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.