5-Methyl-1h-imidazole-4-sulfonic acid

Base Information

• Chemical Name: 5-Methyl-1h-imidazole-4-sulfonic acid
• CAS No.: 6307-14-8
• Molecular Formula: C4H6 N2 O3 S
• Molecular Weight: 162.169
• Hs Code.: 2933290090
• NSC Number: 41089
• DSSTox Substance ID: DTXSID20285216
• Nikkaji Number: J1.555.518A
• Wikidata: Q72491604
• Mol file: 6307-14-8.mol

Synonyms:6307-14-8;5-methyl-1h-imidazole-4-sulfonic acid;5-METHYLIMIDAZOLE-4-SULFONIC ACID;4-Methyl-1H-imidazole-5-sulfonic acid;NSC41089;SCHEMBL10714709;SCHEMBL18116876;DTXSID20285216;NSC 41089;NSC-41089

Chemical Property of 5-Methyl-1h-imidazole-4-sulfonic acid

Chemical Property:

• PSA: 91.43000
• Density: 1.621g/cm³
• LogP: 1.04560
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 162.00991323
• Heavy Atom Count: 10
• Complexity: 207

Purity/Quality:

98%min ^*data from raw suppliers

5-methylimidazole-4-sulfonicacid 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(N=CN1)S(=O)(=O)O