7-Methoxy-2-(methylsulfanyl)-1-benzofuran-3(2H)-one
Basic information
- CAS
51175-51-0- Standard SMILES
COc1cccc2c1OC(SC)C2=O- InChIKey
UGSGDIMIJGDGRT-UHFFFAOYSA-N- Molecular formula
- C10H10O3S
- Average molar mass
- 210.25 g/mol
- Monoisotopic mass
- 210.03506535
Names & identifiers
- Preferred name
- 7-Methoxy-2-(methylsulfanyl)-1-benzofuran-3(2H)-one
- IUPAC
- 7-methoxy-2-methylsulfanyl-1-benzofuran-3-one
Names & synonyms
51175-51-07-methoxy-2-(methylthio)benzofuran-3(2H)-one7-Methoxy-2-(methylsulfanyl)-1-benzofuran-3(2H)-oneSCHEMBL11709227DTXSID10507797
Database identifiers
- CAS
51175-51-0- PubChem CID
- 12715519
- DTXSID
DTXSID10507797
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 231
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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