![3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid structure](/static/products/899/899589-36-7.png)
3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid
TL;DR: 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid (CAS 899589-36-7) is a chemical compound with molecular formula C18H23NO3 and molecular weight 301.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
Also Known As: 2-[(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-3-carboxylic acid, 3-((3,4-dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid, 3-[(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid, 3-[N-(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid, 7-[(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-8-carboxylic Acid
| Molecular Formula | C18H23NO3 |
|---|---|
| Molecular Weight | 301.17 g/mol |
| LogP | 3.37894 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.1678 |
| Heavy Atoms | 22 |
| Complexity | 602.34985 |
Chemical Identifiers
| CAS Number | 899589-36-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C2C3CCC(C2C(=O)O)CC3)C |
Product Overview
3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid (CAS 899589-36-7), with molecular formula C18H23NO3 and molecular weight 301.17 g/mol. IUPAC: 3-[(3,4-dimethylphenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid.
Chemical Property Profile of 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid
Property Insights of 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid
The XLogP value of 3.37894 indicates that 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid. Following Lipinski's Rule of Five, 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid has 2 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 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid?
The CAS number of 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid is 899589-36-7.
What is the molecular formula of 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid?
The molecular formula of 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid is C18H23NO3.
What is the molecular weight of 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid?
The molecular weight of 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid is 301.17 g/mol.
Where can I buy 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid?
You can request a quote for 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((3,4-Dimethylphenyl)carbamoyl)bicyclo[2.2.2]octane-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.