1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate
TL;DR: 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate (CAS 58585-84-5) is a chemical compound with molecular formula C15H9NO4 and molecular weight 267.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,3-dioxoisoindol-2-yl) benzoate
Also Known As: N-benzoyloxyphthalimide, N-Benzoyloxy-phthalimid, 1,3-Dioxoisoindolin-2-yl benzoate, N-(Benzoyloxy)phthalimide, (1,3-dioxoisoindol-2-yl) Benzoate
| Molecular Formula | C15H9NO4 |
|---|---|
| Molecular Weight | 267.05 g/mol |
| LogP | 2.0546 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.05316 |
| Heavy Atoms | 20 |
| Complexity | 673.82324 |
Chemical Identifiers
| CAS Number | 58585-84-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)ON2C(=O)C3=CC=CC=C3C2=O |
Product Overview
1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate (CAS 58585-84-5), with molecular formula C15H9NO4 and molecular weight 267.05 g/mol. IUPAC: (1,3-dioxoisoindol-2-yl) benzoate.
Chemical Property Profile of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate
Property Insights of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate
The XLogP value of 2.0546 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate. Following Lipinski's Rule of Five, 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate 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-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate?
The CAS number of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate is 58585-84-5.
What is the molecular formula of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate?
The molecular formula of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate is C15H9NO4.
What is the molecular weight of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate?
The molecular weight of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate is 267.05 g/mol.
Where can I buy 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate?
You can request a quote for 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.