Methyl naphthalene-2-sulfonate

Base Information

• Chemical Name: Methyl naphthalene-2-sulfonate
• CAS No.: 5138-53-4
• Molecular Formula: C11H10O3S
• Molecular Weight: 222.265
• DSSTox Substance ID: DTXSID20509106
• Nikkaji Number: J689.492E
• Wikidata: Q82366467
• Mol file: 5138-53-4.mol

Synonyms:methyl naphthalene-2-sulfonate;5138-53-4;2-Naphthalenesulfonic acid, methyl ester;SCHEMBL3633735;DTXSID20509106;AFVPRVLDAPXRCX-UHFFFAOYSA-N

Chemical Property of Methyl naphthalene-2-sulfonate

Chemical Property:

• XLogP3: 1.2
• 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:

99% ^*data from raw suppliers

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COS(=O)(=O)C1=CC2=CC=CC=C2C=C1

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