4-Ethylpyridine-3-sulfonic acid

Base Information

• Chemical Name: 4-Ethylpyridine-3-sulfonic acid
• CAS No.: 802259-86-5
• Molecular Formula: C7H9NO3S
• Molecular Weight: 187.21626
• DSSTox Substance ID: DTXSID40704555
• Wikidata: Q82637011
• Mol file: 802259-86-5.mol

Synonyms:4-Ethylpyridine-3-sulfonic acid;802259-86-5;DTXSID40704555;FT-0711386

Chemical Property of 4-Ethylpyridine-3-sulfonic acid

Chemical Property:

• PSA: 75.64000
• LogP: 1.97150
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 187.03031432
• Heavy Atom Count: 12
• Complexity: 232

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=C(C=NC=C1)S(=O)(=O)O