Substance
- Substance Name: 1-(4-(methylsulfonyl)phenyl)ethanone
- Formula: C9H10O3S
- Molecular Weight: 198.24 g/mol
- Identifiers:
- casrn: 10297-73-1
- pubchemId: 82529
- iupacname: 1-(4-methylsulfonylphenyl)ethanone
- inchi: InChI=1S/C9H10O3S/c1-7(10)8-3-5-9(6-4-8)13(2,11)12/h3-6H,1-2H3
- inchikey: KAVZYDHKJNABPC-UHFFFAOYSA-N
- csmiles: CC(=O)C1=CC=C(C=C1)S(=O)(=O)C
- ismiles: CC(=O)C1=CC=C(C=C1)S(=O)(=O)C
- wikidataId: Q27272383
- chemspiderId: 74480
- dsstoxcmpId: DTXCID4068084
- chemblId: CHEMBL41043
- ecnumber: 233-672-0
1-(4-(methylsulfonyl)phenyl)ethanone
Systems and Datasets
- 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 1 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 1, Quantity: Normal melting temperature)
- ethyl acetate + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 2 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- methanol + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 3 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- n-propyl alcohol + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 5 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- n-butyl alcohol + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 6 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- n-hexane + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 7 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- cyclohexane + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 9 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- isobutyl alcohol + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 10 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- n-hexane + ethyl acetate + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 11 in paper 10.1021/acs.jced.6b00617 (Dataseries: 8, Datapoints: 88, Quantity: Mole fraction)
- ethanol + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 4 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)
- 1,2-ethanediol + 1-(4-(methylsulfonyl)phenyl)ethanone (Datasets: 1)
- Dataset 8 in paper 10.1021/acs.jced.6b00617 (Dataseries: 1, Datapoints: 11, Quantity: Mole fraction)