Phenylmethanesulfonic Acid, 4-formylphenyl Ester

Base Information

• Chemical Name: Phenylmethanesulfonic Acid, 4-formylphenyl Ester
• CAS No.: 62162-76-9
• Molecular Formula: C14H12O4S
• Molecular Weight: 276.30800
• DSSTox Substance ID: DTXSID50400253
• Wikidata: Q82203133
• Mol file: 62162-76-9.mol

Synonyms:(4-formylphenyl) phenylmethanesulfonate;62162-76-9;Phenylmethanesulfonic Acid, 4-formylphenyl Ester;4-formylphenyl phenylmethanesulfonate;SCHEMBL6480996;DTXSID50400253;FOMIWSUBUKVBNV-UHFFFAOYSA-N;AL-398/12677102

Chemical Property of Phenylmethanesulfonic Acid, 4-formylphenyl Ester

Chemical Property:

• PSA: 68.82000
• LogP: 3.48870
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 276.04563003
• Heavy Atom Count: 19
• Complexity: 371

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CS(=O)(=O)OC2=CC=C(C=C2)C=O