1-(2-(1,4-Benzodioxanyl)methyl)-4-(2-hydroxyethyl)piperazine hemifumarate

Base Information

• Chemical Name: 1-(2-(1,4-Benzodioxanyl)methyl)-4-(2-hydroxyethyl)piperazine hemifumarate
• CAS No.: 53073-95-3
• Molecular Formula: C34H48N4O10
• Molecular Weight: 672.7657

Synonyms:CRL 40040;1-(2-(1,4-Benzodioxanyl)methyl)-4-(2-hydroxyethyl)piperazine hemifumarate;2-Piperazineethanol, 4-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)-, (E)-2- butenedioate (2:1) (salt);53073-95-3;C30H44N4O6.C4H4O4;LS-112264;C30-H44-N4-O6.C4-H4-O4

Chemical Property of 1-(2-(1,4-Benzodioxanyl)methyl)-4-(2-hydroxyethyl)piperazine hemifumarate

Chemical Property:

• Vapor Pressure: 1.16E-08mmHg at 25°C
• Boiling Point: 443.9°Cat760mmHg
• Flash Point: 222.3°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 10
• Exact Mass: 672.33704374
• Heavy Atom Count: 48
• Complexity: 422

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CC(N1)CCO)CC2COC3=CC=CC=C3O2.C1CN(CC(N1)CCO)CC2COC3=CC=CC=C3O2.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: C1CN(CC(N1)CCO)CC2COC3=CC=CC=C3O2.C1CN(CC(N1)CCO)CC2COC3=CC=CC=C3O2.C(=C/C(=O)O)\C(=O)O

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