1-(3-methyl-1,1-dioxo-2H-thiet-4-yl)ethanone
Basic information
- CAS
32623-93-1- Standard SMILES
CC(=O)C1=C(C)CS1(=O)=O- InChIKey
PLDPCURXQKEEGD-UHFFFAOYSA-N- Molecular formula
- C6H8O3S
- Average molar mass
- 160.19 g/mol
Names & identifiers
- Preferred name
- 1-(3-methyl-1,1-dioxo-2H-thiet-4-yl)ethanone
- IUPAC
- 1-(3-methyl-1,1-dioxo-2H-thiet-4-yl)ethanone
- English name
- Ketone, methyl 3-methyl-2H-thiet-4-yl, S,S-dioxide (8CI)
- Molecular formula
- C6H8O3S
- Molecular weight
- 160.19092
Names & synonyms
32623-93-1Ketone, methyl 3-methyl-2H-thiet-4-yl, S,S-dioxide (8CI)
Database identifiers
- CAS
32623-93-1
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 302
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Compound notes
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