1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid
TL;DR: 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid (CAS 162733-00-8) is a chemical compound with molecular formula C13H14Cl2O2 and molecular weight 272.03708 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,4-dichlorophenyl)cyclohexane-1-carboxylic acid
Also Known As: 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid, 1-(3,4-dichlorophenyl)cyclohexane-1-carboxylic acid, 3,4-dichloro-phenylbiguanide, 1-(3,4-DICHLOROPHENYL)-CYCLOHEXANECARBOXYLIc acid, 1-(3,4-Dichloro-phenyl)-cyclohexanecarboxylic acid
Technical Specifications
| Molecular Formula | C13H14Cl2O2 |
| Molecular Weight | 272.03708 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.03708 Da |
| Heavy Atoms | 17 |
| Complexity | 287.0 |
| SMILES | C1CCC(CC1)(C2=CC(=C(C=C2)Cl)Cl)C(=O)O |
| InChIKey | QEGCUNHOEAACFK-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid
Property Insights of 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid
The XLogP value of 4.6 indicates that 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid?
The CAS number of 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid is 162733-00-8.
What is the molecular formula of 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid?
The molecular formula of 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid is C13H14Cl2O2.
What is the molecular weight of 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid?
The molecular weight of 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid is 272.03708 g/mol.
Where can I buy 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid?
You can request a quote for 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1-(3,4-dichlorophenyl)Cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.