3-[(3,4,5-trimethoxyphenyl)methylamino]propane-1-sulfonic Acid

Base Information

• Chemical Name: 3-[(3,4,5-trimethoxyphenyl)methylamino]propane-1-sulfonic Acid
• CAS No.: 720699-19-4
• Molecular Formula: C13H21NO6S
• DSSTox Substance ID: DTXSID30459966
• Wikidata: Q82283860

Synonyms:3-[(3,4,5-trimethoxyphenyl)methylamino]propane-1-sulfonic Acid;720699-19-4;SCHEMBL918022;DTXSID30459966;XRVODYMKWSKHAI-UHFFFAOYSA-N;3-(3,4,5-trimethoxybenzyl)amino-1-propanesulfonic acid

Chemical Property of 3-[(3,4,5-trimethoxyphenyl)methylamino]propane-1-sulfonic Acid

Chemical Property:

• XLogP3: -1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 319.10895856
• Heavy Atom Count: 21
• Complexity: 369

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=CC(=C1OC)OC)CNCCCS(=O)(=O)O

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