Ethyl (methylsulphinyl)acetate
Basic information
- CAS
4455-14-5- Standard SMILES
CCOC(=O)CS(C)=O- InChIKey
NYFJEHXSUUKIOH-UHFFFAOYSA-N- Molecular formula
- C5H10O3S
- Average molar mass
- 150.2 g/mol
- Monoisotopic mass
- 150.03506535
Names & identifiers
- Preferred name
- Ethyl (methylsulphinyl)acetate
- IUPAC
- ethyl 2-methylsulfinylacetate
- English name
- ethyl (methylsulphinyl)acetate
- Molecular formula
- C5H10O3S
- Molecular weight
- 150.1961
Names & synonyms
Ethyl (methylsulphinyl)acetate4455-14-5EINECS 224-701-8Ethyl (methanesulfinyl)acetateSCHEMBL9567269DTXSID40963241NYFJEHXSUUKIOH-UHFFFAOYSA-NAKOS010555044NS00047507(Methylsulfinyl)acetic acid ethyl ester
Database identifiers
- CAS
4455-14-5- PubChem CID
- 78200
- DTXSID
DTXSID40963241- EC Number
- 224-701-8
- Nikkaji
- J205.843J
Properties
Computed structural properties
- XLogP
- -0.2
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 121
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Related reactions
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Compound notes
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