(1,3-Dioxoisoindol-2-yl) 3-methylbenzoate
TL;DR: (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate (CAS 732258-83-2) is a chemical compound with molecular formula C16H11NO4 and molecular weight 281.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,3-dioxoisoindol-2-yl) 3-methylbenzoate
Also Known As: (1,3-dioxoisoindol-2-yl) 3-methylbenzoate, 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl 3-methylbenzoate, 1,3-DIOXOISOINDOLIN-2-YL 3-METHYLBENZOATE, 1,3-DIOXOISOINDOL-2-YL 3-METHYLBENZOATE, 2-{[(3-methylphenyl)carbonyl]oxy}-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C16H11NO4 |
|---|---|
| Molecular Weight | 281.07 g/mol |
| LogP | 2.36302 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.06882 |
| Heavy Atoms | 21 |
| Complexity | 731.3772 |
Chemical Identifiers
| CAS Number | 732258-83-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)ON2C(=O)C3=CC=CC=C3C2=O |
Product Overview
(1,3-Dioxoisoindol-2-yl) 3-methylbenzoate (CAS 732258-83-2), with molecular formula C16H11NO4 and molecular weight 281.07 g/mol. IUPAC: (1,3-dioxoisoindol-2-yl) 3-methylbenzoate.
Chemical Property Profile of (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate
Property Insights of (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate
The XLogP value of 2.36302 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate. Following Lipinski's Rule of Five, (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate 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 (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate?
The CAS number of (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate is 732258-83-2.
What is the molecular formula of (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate?
The molecular formula of (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate is C16H11NO4.
What is the molecular weight of (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate?
The molecular weight of (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate is 281.07 g/mol.
Where can I buy (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate?
You can request a quote for (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (1,3-Dioxoisoindol-2-yl) 3-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.