Isoquinoline, 1-(2-((p-chlorophenyl)sulfinyl)ethyl)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-, fumarate (1:1)

Base Information

• Chemical Name: Isoquinoline, 1-(2-((p-chlorophenyl)sulfinyl)ethyl)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-, fumarate (1:1)
• CAS No.: 22973-05-3
• Molecular Formula: C24H28ClNO7S
• Molecular Weight: 509.9996

Synonyms:22973-05-3;Isoquinoline, 1-(2-((p-chlorophenyl)sulfinyl)ethyl)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-, fumarate (1:1);C20H24ClNO3S.C4H4O4;LS-85487;C20-H24-Cl-N-O3-S.C4-H4-O4

Chemical Property of Isoquinoline, 1-(2-((p-chlorophenyl)sulfinyl)ethyl)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-, fumarate (1:1)

Chemical Property:

• Vapor Pressure: 1.03E-11mmHg at 25°C
• Boiling Point: 539.7°Cat760mmHg
• Flash Point: 280.2°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 509.1275011
• Heavy Atom Count: 34
• Complexity: 601

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Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[NH+]1CCC2=CC(=C(C=C2C1CCS(=O)C3=CC=C(C=C3)Cl)OC)OC.C(=CC(=O)[O-])C(=O)O
• Isomeric SMILES: C[NH+]1CCC2=CC(=C(C=C2C1CCS(=O)C3=CC=C(C=C3)Cl)OC)OC.C(=C/C(=O)[O-])\C(=O)O

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