Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-
TL;DR: Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo- (CAS 793-68-0) is a chemical compound with molecular formula C17H22O4 and molecular weight 290.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-[(2-methoxyphenyl)methyl]-2-oxocyclohexyl]propanoic acid
Also Known As: 1-(o-Methoxybenzyl)-2-oxocyclohexanepropionic acid, Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-, Acido 2-(o-metossibenzil)cicloessanon-2-beta-propionico, Acido 2-(o-metossibenzil)cicloessanon-2-beta-propionico [Italian], 3-[1-(2-methoxybenzyl)-2-oxocyclohexyl]propanoic acid
| Molecular Formula | C17H22O4 |
|---|---|
| Molecular Weight | 290.15 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 290.1518 |
| Heavy Atoms | 21 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 793-68-0 |
|---|---|
| SMILES | COC1=CC=CC=C1CC2(CCCCC2=O)CCC(=O)O |
| InChIKey | BQRWJPVPSAFIRY-UHFFFAOYSA-N |
Product Overview
Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo- (CAS 793-68-0), with molecular formula C17H22O4 and molecular weight 290.15 g/mol. IUPAC: 3-[1-[(2-methoxyphenyl)methyl]-2-oxocyclohexyl]propanoic acid.
Chemical Property Profile of Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-
Property Insights of Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-. Following Lipinski's Rule of Five, Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo- has 1 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 Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-?
The CAS number of Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo- is 793-68-0.
What is the molecular formula of Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-?
The molecular formula of Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo- is C17H22O4.
What is the molecular weight of Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-?
The molecular weight of Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo- is 290.15 g/mol.
Where can I buy Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-?
You can request a quote for Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanepropionic acid, 1-(o-methoxybenzyl)-2-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.