N-(2-Nitrophenyl)-N-phenyl-2-(4-methyl-1-piperazinyl)acetamide dimaleate hemihydrate

Base Information

• Chemical Name: N-(2-Nitrophenyl)-N-phenyl-2-(4-methyl-1-piperazinyl)acetamide dimaleate hemihydrate
• CAS No.: 118989-82-5
• Molecular Formula: C27H30N4O11
• Molecular Weight: 586.5473
• Mol file: 118989-82-5.mol

Synonyms:N-(2-Nitrophenyl)-N-phenyl-2-(4-methyl-1-piperazinyl)acetamide dimaleate hemihydrate;1-Piperazineacetamide, 4-methyl-N-(2-nitrophenyl)-N-phenyl-, (Z)-2-butenedioate (1:2), 1/2H2O;118989-82-5;Acetamide, 2-(4-methyl-1-piperazinyl)-N-(2-nitrophenyl)-N-phenyl-, (Z)-2-butenedioate, hydrate (2:4:1);C19H22N4O3.2C4H4O4.1/2H2O;C19-H22-N4-O3.2C4-H4-O4.1/2H2-O

Chemical Property of N-(2-Nitrophenyl)-N-phenyl-2-(4-methyl-1-piperazinyl)acetamide dimaleate hemihydrate

Chemical Property:

• Vapor Pressure: 8.67E-13mmHg at 25°C
• Boiling Point: 565°Cat760mmHg
• Flash Point: 295.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 8
• Exact Mass: 586.19110779
• Heavy Atom Count: 42
• Complexity: 609

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CN(CCN1C2=CC=CC=C2)CC(=O)NC3=CC=CC=C3[N+](=O)[O-].C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CC1N(CCN(C1)CC(=O)NC2=CC=CC=C2[N+](=O)[O-])C3=CC=CC=C3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O