1H-Indole, 3-(2-(4,5-dihydro-1H-imidazol-2-yl)ethyl)-5-methoxy-, mono(4-methylbenzenesulfonate)

Base Information

• Chemical Name: 1H-Indole, 3-(2-(4,5-dihydro-1H-imidazol-2-yl)ethyl)-5-methoxy-, mono(4-methylbenzenesulfonate)
• CAS No.: 57000-36-9
• Molecular Formula: C21H25N3O4S
• Molecular Weight: 415.5059
• DSSTox Substance ID: DTXSID00205614

Synonyms:3-(Imidazoline-2'-ethyl)-5-methoxyindole p-toluenesulphonate;1H-Indole, 3-(2-(4,5-dihydro-1H-imidazol-2-yl)ethyl)-5-methoxy-, mono(4-methylbenzenesulfonate);57000-36-9;DTXSID00205614;C14H17N3O.C7H7O3S;LS-82896;C14-H17-N3-O.C7-H7-O3-S

Chemical Property of 1H-Indole, 3-(2-(4,5-dihydro-1H-imidazol-2-yl)ethyl)-5-methoxy-, mono(4-methylbenzenesulfonate)

Chemical Property:

• Vapor Pressure: 3.2E-10mmHg at 25°C
• Boiling Point: 515.4°Cat760mmHg
• Flash Point: 265.5°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 415.15657746
• Heavy Atom Count: 29
• Complexity: 525

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.COC1=CC2=C(C=C1)NC=C2CCC3=NCCN3

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