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2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one
TL;DR: 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one (CAS 40143-27-9) is a chemical compound with molecular formula C23H28O2 and molecular weight 336.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one
Also Known As: 2-benzyl-8-(, A-methoxybenzyl)cyclooctanone, 2-benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one, 2-Benzyl-8-(alpha-methoxybenzyl)cyclooctanone, N-Acetylalanyl-alanyl-prolyl-alanine chloromethyl ketone
| Molecular Formula | C23H28O2 |
|---|---|
| Molecular Weight | 336.21 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.20892 |
| Heavy Atoms | 25 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 40143-27-9 |
|---|---|
| SMILES | COC(C1CCCCCC(C1=O)CC2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | VWHXVCHGUSNFKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one (CAS 40143-27-9), with molecular formula C23H28O2 and molecular weight 336.21 g/mol. IUPAC: 2-benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one.
Chemical Property Profile of 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one
Property Insights of 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one
The XLogP value of 5.4 indicates that 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one?
The CAS number of 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one is 40143-27-9.
What is the molecular formula of 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one?
The molecular formula of 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one is C23H28O2.
What is the molecular weight of 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one?
The molecular weight of 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one is 336.21 g/mol.
Where can I buy 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one?
You can request a quote for 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-8-[methoxy(phenyl)methyl]cyclooctan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.