1-Piperazinecarboxylic acid, 4-((2-(methylthio)phenyl)methyl)-, ethyl ester, (Z)-2-butenedioate (1:1)

Base Information

• Chemical Name: 1-Piperazinecarboxylic acid, 4-((2-(methylthio)phenyl)methyl)-, ethyl ester, (Z)-2-butenedioate (1:1)
• CAS No.: 59083-85-1
• Molecular Formula: C19H26N2O6S
• Molecular Weight: 410.4845

Synonyms:1-Piperazinecarboxylic acid, 4-((2-(methylthio)phenyl)methyl)-, ethyl ester, (Z)-2-butenedioate (1:1);59083-85-1;C15H22N2O2S.C4H4O4;LS-110964

Chemical Property of 1-Piperazinecarboxylic acid, 4-((2-(methylthio)phenyl)methyl)-, ethyl ester, (Z)-2-butenedioate (1:1)

Chemical Property:

• Vapor Pressure: 1.26E-06mmHg at 25°C
• Boiling Point: 400.6°Cat760mmHg
• Flash Point: 196.1°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 410.15115773
• Heavy Atom Count: 28
• Complexity: 425

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)N1CCN(CC1)CC2=CC=CC=C2SC.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CCOC(=O)N1CCN(CC1)CC2=CC=CC=C2SC.C(=C/C(=O)O)\C(=O)O

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