1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate
TL;DR: 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate (CAS 126812-30-4) is a chemical compound with molecular formula C15H15NO4 and molecular weight 273.1001 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1,3-dioxoisoindol-2-yl) cyclohexanecarboxylate
Also Known As: 1,3-Dioxoisoindolin-2-yl cyclohexanecarboxylate, 2-[(cyclohexylcarbonyl)oxy]-1H-isoindole-1,3(2H)-dione, 1,3-Dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate, (1,3-dioxoisoindol-2-yl) cyclohexanecarboxylate, IDI1_022073
Technical Specifications
| Molecular Formula | C15H15NO4 |
| Molecular Weight | 273.1001 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.1001 Da |
| Heavy Atoms | 20 |
| Complexity | 404.0 |
| SMILES | C1CCC(CC1)C(=O)ON2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | VXTXIRMTGIZWEI-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate
Property Insights of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate
The XLogP value of 3.1 indicates that 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate. Following Lipinski's Rule of Five, 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate has 0 hydrogen bond donor(s) and 4 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-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate?
The CAS number of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate is 126812-30-4.
What is the molecular formula of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate?
The molecular formula of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate is C15H15NO4.
What is the molecular weight of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate?
The molecular weight of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate is 273.1001 g/mol.
Where can I buy 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate?
You can request a quote for 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate?
Yes, CoreyChem provides custom synthesis services for 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.