![Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate structure](/static/products/1776/17768-29-5.webp)
Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate
TL;DR: Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate (CAS 17768-29-5) is a chemical compound with molecular formula C16H24O4 and molecular weight 280.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-(2-methoxy-2-oxoethyl)-1-adamantyl]acetate
Also Known As: ChemDiv1_019098, Dimethyl 1,3-adamantanediacetate, dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate, AKOS BC-0474, 5939AD
| Molecular Formula | C16H24O4 |
|---|---|
| Molecular Weight | 280.17 g/mol |
| LogP | 2.6992 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 280.16745 |
| Heavy Atoms | 20 |
| Complexity | 378.1928 |
Chemical Identifiers
| CAS Number | 17768-29-5 |
|---|---|
| SMILES | COC(=O)CC12CC3CC(C1)CC(C3)(C2)CC(=O)OC |
Product Overview
Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate (CAS 17768-29-5), with molecular formula C16H24O4 and molecular weight 280.17 g/mol. IUPAC: methyl 2-[3-(2-methoxy-2-oxoethyl)-1-adamantyl]acetate.
Chemical Property Profile of Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate
Property Insights of Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate
The XLogP value of 2.6992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate has 0 hydrogen bond donor(s) and 4 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 Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate?
The CAS number of Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate is 17768-29-5.
What is the molecular formula of Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate?
The molecular formula of Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate is C16H24O4.
What is the molecular weight of Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate?
The molecular weight of Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate is 280.17 g/mol.
Where can I buy Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate?
You can request a quote for Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2,2'-tricyclo[3.3.1.1~3,7~]decane-1,3-diyldiacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.