4'-Carboethoxy-3-(4-thiomethylphenyl)propiophenone

Base Information

• Chemical Name: 4'-Carboethoxy-3-(4-thiomethylphenyl)propiophenone
• CAS No.: 898780-97-7
• Molecular Formula: C19H20O3S
• Molecular Weight: 328.4
• DSSTox Substance ID: DTXSID20644369
• Wikidata: Q82556132
• Mol file: 898780-97-7.mol

Synonyms:4'-carboethoxy-3-(4-thiomethylphenyl)propiophenone;898780-97-7;ethyl 4-[3-(4-methylsulfanylphenyl)propanoyl]benzoate;MFCD03843258;DTXSID20644369;AKOS016021294;Ethyl 4-{3-[4-(methylsulfanyl)phenyl]propanoyl}benzoate

Chemical Property of 4'-Carboethoxy-3-(4-thiomethylphenyl)propiophenone

Chemical Property:

• Vapor Pressure: 6.52E-10mmHg at 25°C
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 328.11331567
• Heavy Atom Count: 23
• Complexity: 380

Purity/Quality:

98% ^*data from raw suppliers

4'-carboethoxy-3-(4-thiomethylphenyl)propiophenone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C1=CC=C(C=C1)C(=O)CCC2=CC=C(C=C2)SC

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