[2-Hydroxy-3-(methoxycarbonyl)naphthalen-1-yl]methanesulfonic acid

Base Information

• Chemical Name: [2-Hydroxy-3-(methoxycarbonyl)naphthalen-1-yl]methanesulfonic acid
• CAS No.: 91903-82-1
• Molecular Formula: C13H12O6S
• Molecular Weight: 296.2958
• NSC Number: 46503
• DSSTox Substance ID: DTXSID40286563
• Wikidata: Q82022339

Synonyms:91903-82-1;[2-hydroxy-3-(methoxycarbonyl)naphthalen-1-yl]methanesulfonic acid;NSC46503;DTXSID40286563;NSC-46503

Chemical Property of [2-Hydroxy-3-(methoxycarbonyl)naphthalen-1-yl]methanesulfonic acid

Chemical Property:

• Density: 1.521g/cm³
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 296.03545927
• Heavy Atom Count: 20
• Complexity: 454

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC2=CC=CC=C2C(=C1O)CS(=O)(=O)O

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