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4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one
TL;DR: 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one (CAS 3850-62-2) is a chemical compound with molecular formula C15H18O2 and molecular weight 230.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-1-phenylbicyclo[2.2.2]octan-2-one
Also Known As: 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one, Bicyclo[2.2.2]octanone, 4-methoxy-1-phenyl-, 1-methoxy-4-phenylbicyclo[2.2.2]octan-3-one, 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one #, Bicyclo[2.2.2]octan-2-one, 4-methoxy-1-phenyl-
| Molecular Formula | C15H18O2 |
|---|---|
| Molecular Weight | 230.13 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.13068 |
| Heavy Atoms | 17 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 3850-62-2 |
|---|---|
| SMILES | COC12CCC(CC1)(C(=O)C2)C3=CC=CC=C3 |
| InChIKey | FWWRCVAKQXSYQQ-UHFFFAOYSA-N |
Product Overview
4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one (CAS 3850-62-2), with molecular formula C15H18O2 and molecular weight 230.13 g/mol. IUPAC: 4-methoxy-1-phenylbicyclo[2.2.2]octan-2-one.
Chemical Property Profile of 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one
Property Insights of 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one 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 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one?
The CAS number of 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one is 3850-62-2.
What is the molecular formula of 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one?
The molecular formula of 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one is C15H18O2.
What is the molecular weight of 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one?
The molecular weight of 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one is 230.13 g/mol.
Where can I buy 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one?
You can request a quote for 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-1-phenylbicyclo[2.2.2]octan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.