![[4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate structure](/static/products/132/1322217-24-2.webp)
[4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate
TL;DR: [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate (CAS 1322217-24-2) is a chemical compound with molecular formula C26H27NO4 and molecular weight 417.194 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(1-adamantyliminomethyl)phenyl] 2-acetyloxybenzoate
Also Known As: [4-(1-adamantyliminomethyl)phenyl] 2-acetyloxybenzoate|F1556-0072|4-[(1E)-[(adamantan-1-yl)imino]methyl]phenyl 2-(acetyloxy)benzoate|p-[(E)-(1-adamantanylimino)methyl]phenyl o-acetoxybenzoate|4-((E)-((3s,5s,7s)-adamantan-1-ylimino)methyl)phenyl 2-acetoxybenzoate|SMSSF-0041589
Technical Specifications
| Molecular Formula | C26H27NO4 |
| Molecular Weight | 417.194 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 65.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 417.194 Da |
| Heavy Atoms | 31 |
| Complexity | 667.0 |
| SMILES | CC(=O)OC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)C=NC34CC5CC(C3)CC(C5)C4 |
| InChIKey | AGWMLBKIBKKELH-UHFFFAOYSA-N |
Chemical Property Profile of [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate
Property Insights of [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate
The XLogP value of 5.1 indicates that [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate. Following Lipinski's Rule of Five, [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate?
The CAS number of [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate is 1322217-24-2.
What is the molecular formula of [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate?
The molecular formula of [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate is C26H27NO4.
What is the molecular weight of [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate?
The molecular weight of [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate is 417.194 g/mol.
Where can I buy [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate?
You can request a quote for [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate?
Yes, CoreyChem provides custom synthesis services for [4-(1-Adamantyliminomethyl)phenyl] 2-acetyloxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.