3-[(2,4-Dimethoxyphenyl)methylamino]propane-1-sulfonic acid

Base Information

• Chemical Name: 3-[(2,4-Dimethoxyphenyl)methylamino]propane-1-sulfonic acid
• CAS No.: 720699-22-9
• Molecular Formula: C12H19NO5S
• DSSTox Substance ID: DTXSID70465203
• Wikidata: Q82290981

Synonyms:720699-22-9;AGN-PC-008NCY;SCHEMBL918214;DTXSID70465203

Chemical Property of 3-[(2,4-Dimethoxyphenyl)methylamino]propane-1-sulfonic acid

Chemical Property:

• XLogP3: -1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 289.09839388
• Heavy Atom Count: 19
• Complexity: 341

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1)CNCCCS(=O)(=O)O)OC

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