4-(1-(5-Chloro-2-(phenylthio)phenyl)ethyl)-1-piperazineethanol (Z)-2-butenedioate (1:2)

Base Information

• Chemical Name: 4-(1-(5-Chloro-2-(phenylthio)phenyl)ethyl)-1-piperazineethanol (Z)-2-butenedioate (1:2)
• CAS No.: 112446-52-3
• Molecular Formula: C28H33ClN2O9S
• Molecular Weight: 609.0876
• Mol file: 112446-52-3.mol

Synonyms:4-(1-(5-Chloro-2-(phenylthio)phenyl)ethyl)-1-piperazineethanol (Z)-2-butenedioate (1:2);1-(1-(5-Chloro-2-(phenylthio)phenyl)ethyl)-4-(2-hydroxyethyl)piperazine bis(hydrogen maleate);1-Piperazineethanol, 4-(1-(5-chloro-2-(phenylthio)phenyl)ethyl)-, (Z)-2-butenedioate (1:2);112446-52-3;C20H25ClN2OS.2C4H4O4;LS-112221;C20-H25-Cl-N2-O-S.2C4-H4-O4

Chemical Property of 4-(1-(5-Chloro-2-(phenylthio)phenyl)ethyl)-1-piperazineethanol (Z)-2-butenedioate (1:2)

Chemical Property:

• Vapor Pressure: 8.61E-11mmHg at 25°C
• Boiling Point: 499.4°Cat760mmHg
• Flash Point: 255.8°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 10
• Exact Mass: 608.1595295
• Heavy Atom Count: 41
• Complexity: 505

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=C(C=CC(=C1)Cl)SC2=CC=CC=C2)N3CCN(CC3)CCO.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CC(N1CCN(CC1)CCO)C2=C(C=CC(=C2)Cl)SC3=CC=CC=C3.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O