2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
TL;DR: 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate (CAS 101855-38-3) is a chemical compound with molecular formula C14H15NO4 and molecular weight 261.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 2-(1,3-dioxoisoindol-2-yl)acetate
Also Known As: 2-methylpropyl 2-(1,3-dioxoisoindol-2-yl)acetate, 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate, 2-Methylpropyl 1,3-dihydro-1,3-dioxo-2H-isoindole-2-acetate
| Molecular Formula | C14H15NO4 |
|---|---|
| Molecular Weight | 261.10 g/mol |
| LogP | 1.4818 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.1001 |
| Heavy Atoms | 19 |
| Complexity | 501.00244 |
Chemical Identifiers
| CAS Number | 101855-38-3 |
|---|---|
| SMILES | CC(C)COC(=O)CN1C(=O)C2=CC=CC=C2C1=O |
Product Overview
2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate (CAS 101855-38-3), with molecular formula C14H15NO4 and molecular weight 261.10 g/mol. IUPAC: 2-methylpropyl 2-(1,3-dioxoisoindol-2-yl)acetate.
Chemical Property Profile of 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
Property Insights of 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
The XLogP value of 1.4818 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate. Following Lipinski's Rule of Five, 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate 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
Frequently Asked Questions
What is the CAS number of 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
The CAS number of 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate is 101855-38-3.
What is the molecular formula of 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
The molecular formula of 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate is C14H15NO4.
What is the molecular weight of 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
The molecular weight of 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate is 261.10 g/mol.
Where can I buy 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
You can request a quote for 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-methylpropyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.