1-Piperazineethanol, 4-(10,11-dihydro-8-methoxydibenzo(b,f)thiepin-10-yl)-, methanesulfonate,hydrate (2:4:1)

Base Information

• Chemical Name: 1-Piperazineethanol, 4-(10,11-dihydro-8-methoxydibenzo(b,f)thiepin-10-yl)-, methanesulfonate,hydrate (2:4:1)
• CAS No.: 61015-54-1
• Molecular Formula: C23H34N2O8S3
• Molecular Weight: 562.7197
• DSSTox Substance ID: DTXSID50976509

Synonyms:VUFB10,044;1-Piperazineethanol, 4-(10,11-dihydro-8-methoxydibenzo(b,f)thiepin-10-yl)-, methanesulfonate,hydrate (2:4:1);61015-54-1;DTXSID50976509;LS-112299;C21H26N2O2S.2CH4O3S.1/2H2O;C21-H26-N2-O2-S.2C-H4-O3-S.1/2H2-O;Methanesulfonic acid--2-[4-(8-methoxy-10,11-dihydrodibenzo[b,f]thiepin-10-yl)piperazin-1-yl]ethan-1-ol (2/1)

Chemical Property of 1-Piperazineethanol, 4-(10,11-dihydro-8-methoxydibenzo(b,f)thiepin-10-yl)-, methanesulfonate,hydrate (2:4:1)

Chemical Property:

• Vapor Pressure: 2.15E-11mmHg at 25°C
• Boiling Point: 514.1°Cat760mmHg
• Flash Point: 264.7°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 4
• Exact Mass: 562.14772957
• Heavy Atom Count: 36
• Complexity: 536

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=C(C=C1)SC3=CC=CC=C3CC2N4CCN(CC4)CCO.CS(=O)(=O)O.CS(=O)(=O)O

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