Butyrophenone, 4'-fluoro-4-(9-methoxy-1,4,5,6-tetrahydroazepino(4,5-b)indol-3(2H)-yl)-, cyclohexanesulfamate

Base Information

• Chemical Name: Butyrophenone, 4'-fluoro-4-(9-methoxy-1,4,5,6-tetrahydroazepino(4,5-b)indol-3(2H)-yl)-, cyclohexanesulfamate
• CAS No.: 23901-27-1
• Molecular Formula: C29H38FN3O5S
• Molecular Weight: 559.6925
• DSSTox Substance ID: DTXSID30178605

Synonyms:23901-27-1;Butyrophenone, 4'-fluoro-4-(9-methoxy-1,4,5,6-tetrahydroazepino(4,5-b)indol-3(2H)-yl)-, cyclohexanesulfamate;DTXSID30178605;C23H25FN2O2.C6H13O3S;LS-48393;C23-H25-F-N2-O2.C6-H13-O3-S

Chemical Property of Butyrophenone, 4'-fluoro-4-(9-methoxy-1,4,5,6-tetrahydroazepino(4,5-b)indol-3(2H)-yl)-, cyclohexanesulfamate

Chemical Property:

• Vapor Pressure: 1.93E-13mmHg at 25°C
• Boiling Point: 579.9°Cat760mmHg
• Flash Point: 304.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 559.25162066
• Heavy Atom Count: 39
• Complexity: 710

Purity/Quality:

96% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=C(C=C1)NC3=C2CC[NH+](CC3)CCCC(=O)C4=CC=C(C=C4)F.C1CCC(CC1)NS(=O)(=O)[O-]

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