TL;DR: 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-((2-oxopropoxy)phenyl)- (CAS 54393-00-9) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.11575 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(2-oxopropoxy)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Also Known As: 3a,4,7,7a-Tetrahydro-2-((2-oxopropoxy)phenyl)-1H-isoindole-1,3(2H)-dione, N-(4-Acetonyloksy)-fenylo imid kwasu 1,2,3,6-tetrahydroftalowego, N-(4-Acetonyloksy)-fenylo imid kwasu 1,2,3,6-tetrahydroftalowego [Polish], 1H-ISOINDOLE-1,3(2H)-DIONE, 3a,4,7,7a-TETRAHYDRO-2-((2-OXOPROPOXY)PHENYL)-, 2-[4-(2-oxopropoxy)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione
| Molecular Formula | C17H17NO4 |
| Molecular Weight | 299.11575 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 63.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.11575 Da |
| Heavy Atoms | 22 |
| Complexity | 479.0 |
| SMILES | CC(=O)COC1=CC=C(C=C1)N2C(=O)C3CC=CCC3C2=O |
| InChIKey | BCOUFUHXZGGFJB-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-((2-oxopropoxy)phenyl)-. The TPSA of 63.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-((2-oxopropoxy)phenyl)-. Following Lipinski's Rule of Five, 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-((2-oxopropoxy)phenyl)- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-((2-oxopropoxy)phenyl)- is 54393-00-9.
The molecular formula of 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-((2-oxopropoxy)phenyl)- is C17H17NO4.
The molecular weight of 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-((2-oxopropoxy)phenyl)- is 299.11575 g/mol.
You can request a quote for 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-((2-oxopropoxy)phenyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for 1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-((2-oxopropoxy)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 54393-00-9. Our professional technical team will respond with pricing and lead time.