3a,4,7,7a-Tetrahydro-2-(4-(2-oxo-2-phenylethoxy)phenyl)-1H-isoindole-1,3(2H)-dione

Base Information

• Chemical Name: 3a,4,7,7a-Tetrahydro-2-(4-(2-oxo-2-phenylethoxy)phenyl)-1H-isoindole-1,3(2H)-dione
• CAS No.: 61356-01-2
• Molecular Formula: C22H19NO4
• Molecular Weight: 361.3906
• DSSTox Substance ID: DTXSID40976876
• Mol file: 61356-01-2.mol

Synonyms:61356-01-2;3a,4,7,7a-Tetrahydro-2-(4-(2-oxo-2-phenylethoxy)phenyl)-1H-isoindole-1,3(2H)-dione;1H-Isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-2-(4-(2-oxo-2-phenylethoxy)phenyl)-;DTXSID40976876;LS-84655;2-[4-(2-Oxo-2-phenylethoxy)phenyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione

Chemical Property of 3a,4,7,7a-Tetrahydro-2-(4-(2-oxo-2-phenylethoxy)phenyl)-1H-isoindole-1,3(2H)-dione

Chemical Property:

• Vapor Pressure: 6.91E-16mmHg at 25°C
• Boiling Point: 632.1°C at 760 mmHg
• Flash Point: 336.1°C
• PSA: 63.68000
• Density: 1.28g/cm³
• LogP: 3.46890
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 361.13140809
• Heavy Atom Count: 27
• Complexity: 588

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C=CCC2C1C(=O)N(C2=O)C3=CC=C(C=C3)OCC(=O)C4=CC=CC=C4