1-(4,6-Bis-crotylamino-s-triazin-2-yl)-4-(benzofuran-2-ylmethyl)piperazine difumarate

Base Information

• Chemical Name: 1-(4,6-Bis-crotylamino-s-triazin-2-yl)-4-(benzofuran-2-ylmethyl)piperazine difumarate
• CAS No.: 87813-80-7
• Molecular Formula: C32H39N7O9
• Molecular Weight: 665.6936

Synonyms:1-(4,6-Bis-crotylamino-s-triazin-2-yl)-4-(benzofuran-2-ylmethyl)piperazine difumarate;1,3,5-Triazine-2,4-diamine, 6-(4-(2-benzofuranylmethyl)-1-piperazinyl)-N,N'-di-2-butenyl-, (E)-2-butenedioate (1:2);87813-80-7;C24H31N7O.2C4H4O4;LS-155212;C24-H31-N7-O.2C4-H4-O4

Chemical Property of 1-(4,6-Bis-crotylamino-s-triazin-2-yl)-4-(benzofuran-2-ylmethyl)piperazine difumarate

Chemical Property:

• Boiling Point: 609.7°Cat760mmHg
• Flash Point: 322.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 13
• Exact Mass: 665.28092585
• Heavy Atom Count: 48
• Complexity: 702

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=CCNC1=NC(=NC(=N1)N2CCN(CC2)CC3=CC4=CC=CC=C4O3)NCC=CC.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: C/C=C/CNC1=NC(=NC(=N1)N2CCN(CC2)CC3=CC4=CC=CC=C4O3)NC/C=C/C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

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