2-Methyl-1-[4-(methylthio)phenyl]-1-propanone
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![2-Methyl-1-[4-(methylthio)phenyl]-1-propanone structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/6902327165b0485695566318361c838c.png "2-Methyl-1-[4-(methylthio)phenyl]-1-propanone")
2-Methyl-1-[4-(methylthio)phenyl]-1-propanone
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CAS No:
53207-58-2
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Formula:
C11H14OS
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Chemical Name:
2-Methyl-1-[4-(methylthio)phenyl]-1-propanone
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Synonyms:
1-Propanone,2-methyl-1-[4-(methylthio)phenyl]-;2-Methyl-1-[4-(methylthio)phenyl]-1-propanone;p-(Methylthio)isobutyrophenone;2-Methyl-1-(4-methylsulfanylphenyl)propan-1-one
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CAS No:
Safety Information
H412 (98.86%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]|P273, and P501|Aggregated GHS information provided by 88 companies from 2 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:194.30
XLogP3:3.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:194.07653624
Monoisotopic Mass:194.07653624
Topological Polar Surface Area:42.4
Heavy Atom Count:13
Complexity:169
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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