1-Naphthalenesulfonic acid, methyl ester

Base Information

• Chemical Name: 1-Naphthalenesulfonic acid, methyl ester
• CAS No.: 5138-52-3
• Molecular Formula: C11H10O3S
• Molecular Weight: 222.265
• DSSTox Substance ID: DTXSID30895764
• Wikidata: Q81982908
• Mol file: 5138-52-3.mol

Synonyms:5138-52-3;1-Naphthalenesulfonic acid, methyl ester;methyl naphthalene-1-sulfonate;Methyl 1-naphalenesulfonate;Methyl 1-naphthalenesulfonate;SCHEMBL1002263;DTXSID30895764

Chemical Property of 1-Naphthalenesulfonic acid, methyl ester

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 222.03506535
• Heavy Atom Count: 15
• Complexity: 304

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COS(=O)(=O)C1=CC=CC2=CC=CC=C21