2-Phenoxyethyl (methylsulfanyl)acetate
Basic information
- CAS
60359-66-2- Standard SMILES
CSCC(=O)OCCOc1ccccc1- InChIKey
MGZHNMZBLPCXND-UHFFFAOYSA-N- Molecular formula
- C11H14O3S
- Average molar mass
- 226.29 g/mol
- Monoisotopic mass
- 226.06636548
Names & identifiers
- Preferred name
- 2-Phenoxyethyl (methylsulfanyl)acetate
- IUPAC
- 2-phenoxyethyl 2-methylsulfanylacetate
Names & synonyms
60359-66-22-Phenoxyethyl (methylsulfanyl)acetateDTXSID60822144
Database identifiers
- CAS
60359-66-2- PubChem CID
- 71400902
- DTXSID
DTXSID60822144
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 179
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…