3-Fluoro-11-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin methanesulfonate

Base Information

• Chemical Name: 3-Fluoro-11-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin methanesulfonate
• CAS No.: 76242-99-4
• Molecular Formula: C20H25FN2O3S2
• Molecular Weight: 424.5525
• DSSTox Substance ID: DTXSID40997586

Synonyms:VUFB-12297;3-Fluoro-11-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin methanesulfonate;1-(10,11-Dihydro-7-fluorodibenzo(b,f)thiepin-10-yl)-4-methylpiperazine methanesulfonate;76242-99-4;Piperazine, 1-(10,11-dihydro-7-fluorodibenzo(b,f)thiepin-10-yl)-4-methyl-, monomethanesulfonate;C19H21FN2S.CH4O3S;DTXSID40997586;LS-111633;C19-H21-F-N2-S.C-H4-O3-S;Methanesulfonic acid--1-(7-fluoro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-4-methylpiperazine (1/1)

Chemical Property of 3-Fluoro-11-(4-methylpiperazino)-10,11-dihydrodibenzo(b,f)thiepin methanesulfonate

Chemical Property:

• Vapor Pressure: 5.62E-07mmHg at 25°C
• Boiling Point: 411.3°Cat760mmHg
• Flash Point: 202.6°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 1
• Exact Mass: 424.12906317
• Heavy Atom Count: 28
• Complexity: 491

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCN(CC1)C2CC3=CC=CC=C3SC4=C2C=CC(=C4)F.CS(=O)(=O)O

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