3-(3-Hydroxypropyl)-5-methoxy-2-methylbenzothiazolium iodide

Base Information

• Chemical Name: 3-(3-Hydroxypropyl)-5-methoxy-2-methylbenzothiazolium iodide
• CAS No.: 65776-64-9
• Molecular Formula: C12H16INO2S
• Molecular Weight: 365.2304
• European Community (EC) Number: 265-921-4
• DSSTox Substance ID: DTXSID00886568
• Mol file: 65776-64-9.mol

Synonyms:65776-64-9;3-(3-Hydroxypropyl)-5-methoxy-2-methylbenzothiazolium iodide;EINECS 265-921-4;Benzothiazolium, 3-(3-hydroxypropyl)-5-methoxy-2-methyl-, iodide;Benzothiazolium, 3-(3-hydroxypropyl)-5-methoxy-2-methyl-, iodide (1:1);C12H16NO2S.I;DTXSID00886568;C12-H16-N-O2-S.I

Chemical Property of 3-(3-Hydroxypropyl)-5-methoxy-2-methylbenzothiazolium iodide

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 61.58000
• Density: g/cm³
• LogP: -1.10780
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 364.99465
• Heavy Atom Count: 17
• Complexity: 227

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=[N+](C2=C(S1)C=CC(=C2)OC)CCCO.[I-]

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