Isoquinoline, 3,4-dihydro-7-methoxy-3-((4-methyl-1-piperazinyl)methyl)-1-phenyl-, (Z)-2-butenedioate (1:2)

Base Information

• Chemical Name: Isoquinoline, 3,4-dihydro-7-methoxy-3-((4-methyl-1-piperazinyl)methyl)-1-phenyl-, (Z)-2-butenedioate (1:2)
• CAS No.: 83658-75-7
• Molecular Formula: C30H35N3O9
• Molecular Weight: 581.6136

Synonyms:83658-75-7;Isoquinoline, 3,4-dihydro-7-methoxy-3-((4-methyl-1-piperazinyl)methyl)-1-phenyl-, (Z)-2-butenedioate (1:2);C22H27N3O.2C4H4O4;LS-85548;C22-H27-N3-O.2C4-H4-O4

Chemical Property of Isoquinoline, 3,4-dihydro-7-methoxy-3-((4-methyl-1-piperazinyl)methyl)-1-phenyl-, (Z)-2-butenedioate (1:2)

Chemical Property:

• Vapor Pressure: 1.29E-09mmHg at 25°C
• Boiling Point: 486.4°C at 760 mmHg
• Flash Point: 248°C
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 8
• Exact Mass: 581.23732970
• Heavy Atom Count: 42
• Complexity: 599

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCN(CC1)CC2CC3=C(C=C(C=C3)OC)C(=N2)C4=CC=CC=C4.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CN1CCN(CC1)CC2N=C(C3=C(C2)C=CC(=C3)OC)C4=CC=CC=C4.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

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