Ethyl 2-(4-methoxyphenyl)sulfanylacetate
Basic information
- CAS
28743-98-8- Standard SMILES
CCOC(=O)CSc1ccc(OC)cc1- InChIKey
MFDBJTGAQFVAEB-UHFFFAOYSA-N- Molecular formula
- C11H14O3S
- Average molar mass
- 226.29 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-(4-methoxyphenyl)sulfanylacetate
- IUPAC
- ethyl 2-(4-methoxyphenyl)sulfanylacetate
- English name
- Ethyl 2-[(4-methoxyphenyl)sulfanyl]acetate
- Molecular formula
- C11H14O3S
- Molecular weight
- 226.29
Names & synonyms
ethyl 2-(4-methoxyphenyl)sulfanylacetate28743-98-8ethyl 2-[(4-methoxyphenyl)sulfanyl]acetateMFCD05256227Ethyl 2-[(4-methoxyphenyl)thio]acetateethyl 2-((4-methoxyphenyl)thio)acetate(4-methoxy-phenylsulfanyl)-acetic acid ethyl esterSCHEMBL5860967MFDBJTGAQFVAEB-UHFFFAOYSA-NEthyl (4-methoxyphenylthio)acetateethyl [(4-methoxyphenyl)thio]acetateAKOS005098168
Show more names
ethyl2-(4-methoxyphenyl)sulfanylacetateCS-10171E85471(4-methoxy-phenylsulfanyl)acetic acid ethyl ester6X-0937F095131(4-methoxy- phenylsulfanyl)-acetic acid ethyl esterAcetic acid, 2-[(4-methoxyphenyl)thio]-, ethyl ester
Database identifiers
- CAS
28743-98-8- Nikkaji
- J454.987B
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 188
Physicochemical properties
- Boiling point
- 136 · 136-142 °C(Press: 6 Torr)
- Density
- 1.15 · 1.15±0.1 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesEthyl 2-[(4-methoxyphenyl)sulfanyl]acetate is used as a reactant in the methylrhenium trioxide catalyzed reactions of ethyl diazoacetate and organic azides.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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