Phthalimidoacetone
TL;DR: Phthalimidoacetone (CAS 3580-38-9) is a chemical compound with molecular formula C11H9NO3 and molecular weight 203.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-oxopropyl)isoindole-1,3-dione
Also Known As: Phthalimidoacetone, N-Acetonylphthalimide, 2-(2-oxopropyl)isoindoline-1,3-dione, 2-(2-oxopropyl)isoindole-1,3-dione, 2-(2-Oxopropyl)-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C11H9NO3 |
|---|---|
| Molecular Weight | 203.06 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.05824 |
| Heavy Atoms | 15 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 3580-38-9 |
|---|---|
| SMILES | CC(=O)CN1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | STMRGLKPBJVVEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phthalimidoacetone (CAS 3580-38-9), with molecular formula C11H9NO3 and molecular weight 203.06 g/mol. IUPAC: 2-(2-oxopropyl)isoindole-1,3-dione.
Chemical Property Profile of Phthalimidoacetone
Property Insights of Phthalimidoacetone
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phthalimidoacetone. With a topological polar surface area (TPSA) of 54.5 Ų, Phthalimidoacetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phthalimidoacetone has 0 hydrogen bond donor(s) and 3 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 Phthalimidoacetone?
The CAS number of Phthalimidoacetone is 3580-38-9.
What is the molecular formula of Phthalimidoacetone?
The molecular formula of Phthalimidoacetone is C11H9NO3.
What is the molecular weight of Phthalimidoacetone?
The molecular weight of Phthalimidoacetone is 203.06 g/mol.
Where can I buy Phthalimidoacetone?
You can request a quote for Phthalimidoacetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phthalimidoacetone?
Yes, KEHONG BIO provides custom synthesis services for Phthalimidoacetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.