2-Ethyl-7-fluoro-11-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin maleate

Base Information

• Chemical Name: 2-Ethyl-7-fluoro-11-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin maleate
• CAS No.: 70931-58-7
• Molecular Formula: C25H29FN2O4S
• Molecular Weight: 472.5722

Synonyms:Compound 123330;1-(10,11-Dihydro-8-ethyl-3-fluorodibenzo(b,f)thiepin-10-yl)-4-methylpiperazine maleate;2-Ethyl-7-fluoro-11-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin maleate;8-Ethyl-3-fluoro-10-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin maleate;Piperazine, 1-(10,11-dihydro-8-ethyl-3-fluorodibenzo(b,f)thiepin-10-yl)-4-methyl-, (Z)-2-butenedioate (1:1);70931-58-7;C21H25FN2S.C4H4O4;LS-111625;C21-H25-F-N2-S.C4-H4-O4

Chemical Property of 2-Ethyl-7-fluoro-11-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin maleate

Chemical Property:

• Vapor Pressure: 7.98E-08mmHg at 25°C
• Boiling Point: 436.6°Cat760mmHg
• Flash Point: 217.9°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 472.18320675
• Heavy Atom Count: 33
• Complexity: 559

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MSDS Files:

Useful:

• Canonical SMILES: CCC1=CC2=C(C=C1)SC3=C(CC2N4CCN(CC4)C)C=CC(=C3)F.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CCC1=CC2=C(C=C1)SC3=C(CC2N4CCN(CC4)C)C=CC(=C3)F.C(=C/C(=O)O)\C(=O)O

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