2,3-Dihydroxypropyl nicotinate

Base Information

• Chemical Name: 2,3-Dihydroxypropyl nicotinate
• CAS No.: 40275-04-5
• Molecular Formula: C₉H₁₁NO₄
• Molecular Weight: 197.191
• DSSTox Substance ID: DTXSID401220861
• Nikkaji Number: J691.547G

Synonyms:2,3-Dihydroxypropyl nicotinate;40275-04-5;Glycerin 1-nicotinate;SCHEMBL9122283;DTXSID401220861

Chemical Property of 2,3-Dihydroxypropyl nicotinate

Chemical Property:

• XLogP3: -0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 197.06880783
• Heavy Atom Count: 14
• Complexity: 186

Purity/Quality:

99% ^*data from raw suppliers

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• Canonical SMILES: C1=CC(=CN=C1)C(=O)OCC(CO)O

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